1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene

C120H86B2BrN3O11 — CID 160706383

IUPAC1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene
SMILESBrc1ccccc1Oc1cccc(Oc2ccccc2)c1.Oc1cccc(N(c2ccccc2)c2ccccc2)c1.Oc1cccc(Oc2ccccc2)c1.c1ccc(N2c3ccccc3B3c4ccc5c(c4Oc4cccc2c43)Oc2cccc3c2B5c2ccccc2O3)cc1.c1ccc(Oc2cccc(Oc3ccccc3Oc3cccc(N(c4ccccc4)c4ccccc4)c3)c2)cc1
InChIInChI=1S/C36H21B2NO3.C36H27NO3.C18H13BrO2.C18H15NO.C12H10O2/c1-2-10-22(11-3-1)39-27-14-6-4-12-23(27)37-25-20-21-26-36(35(25)41-30-17-8-15-28(39)33(30)37)42-32-19-9-18-31-34(32)38(26)24-13-5-7-16-29(24)40-31;1-4-14-28(15-5-1)37(29-16-6-2-7-17-29)30-18-12-21-32(26-30)39-35-24-10-11-25-36(35)40-34-23-13-22-33(27-34)38-31-19-8-3-9-20-31;19-17-11-4-5-12-18(17)21-16-10-6-9-15(13-16)20-14-7-2-1-3-8-14;20-18-13-7-12-17(14-18)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16;13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-21H;1-27H;1-13H;1-14,20H;1-9,13H
InChIKeyRRGZARASSSWWSH-UHFFFAOYSA-N
MW1847.55 g/mol
LogP29.43
Rot. Bonds19

About 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene

1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene (PubChem CID 160706383) has the molecular formula C120H86B2BrN3O11 and a molecular weight of 1847.55 g/mol. Its IUPAC name is 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene.

Molecular Properties

Compound Name1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene
PubChem CID160706383
Molecular FormulaC120H86B2BrN3O11
Molecular Weight1847.55 g/mol
Exact Mass1845.56
IUPAC Name1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene
SMILESBrc1ccccc1Oc1cccc(Oc2ccccc2)c1.Oc1cccc(N(c2ccccc2)c2ccccc2)c1.Oc1cccc(Oc2ccccc2)c1.c1ccc(N2c3ccccc3B3c4ccc5c(c4Oc4cccc2c43)Oc2cccc3c2B5c2ccccc2O3)cc1.c1ccc(Oc2cccc(Oc3ccccc3Oc3cccc(N(c4ccccc4)c4ccccc4)c3)c2)cc1
InChIInChI=1S/C36H21B2NO3.C36H27NO3.C18H13BrO2.C18H15NO.C12H10O2/c1-2-10-22(11-3-1)39-27-14-6-4-12-23(27)37-25-20-21-26-36(35(25)41-30-17-8-15-28(39)33(30)37)42-32-19-9-18-31-34(32)38(26)24-13-5-7-16-29(24)40-31;1-4-14-28(15-5-1)37(29-16-6-2-7-17-29)30-18-12-21-32(26-30)39-35-24-10-11-25-36(35)40-34-23-13-22-33(27-34)38-31-19-8-3-9-20-31;19-17-11-4-5-12-18(17)21-16-10-6-9-15(13-16)20-14-7-2-1-3-8-14;20-18-13-7-12-17(14-18)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16;13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-21H;1-27H;1-13H;1-14,20H;1-9,13H
InChIKeyRRGZARASSSWWSH-UHFFFAOYSA-N
XLogP29.43
TPSA133.25 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds19
Heavy Atoms137
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001847.55
LogP ≤ 529.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene with MolForge

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Related Compounds

N,14-diphenyl-N-[3-[3-(3-phenylphenyl)phenyl]phenyl]-8-oxa-14-aza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-amine
CID 140856035
N,N,14-triphenyl-8-oxa-14-aza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-amine
CID 164807342
8,14-dioxa-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaene;1,3-diphenoxybenzene
CID 159581069
3,5-bis(N-phenylanilino)phenol;5-[4-[3,5-bis(N-phenylanilino)phenoxy]carbazol-9-yl]-1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;5-(4-bromocarbazol-9-yl)-1-N,1-N,3-N,3-N-tetraphenylbenzene-1,3-diamine;12-N,12-N,27-N,27-N,9,30-hexakis-phenyl-24-oxa-9,15,30-triaza-2,37-diboraundecacyclo[20.17.1.12,10.125,29.03,8.015,40.016,21.023,38.031,36.014,42.037,41]dotetraconta-1(39),3,5,7,10,12,14(42),16,18,20,22(40),23(38),25,27,29(41),31,33,35-octadecaene-12,27-diamine
CID 158542941
15-N,15-N,25-N,25-N,28-pentakis-phenyl-12,18,22-trioxa-28-aza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23,25,27(35),29,31,33-pentadecaene-15,25-diamine
CID 162496409
N-(9,9-dimethylxanthen-3-yl)-N,14-diphenyl-8-oxa-14-aza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-amine
CID 140855966
magnesium;benzene-1,3-diol;1,3-dimethylbenzene-2-ide;33-(2,6-dimethylphenyl)-N,N,26-triphenyl-12,18,22,36-tetraoxa-26-aza-1,5,33-triboraundecacyclo[21.19.1.15,13.02,21.04,19.06,11.025,34.027,32.035,43.037,42.017,44]tetratetraconta-2(21),3,6,8,10,13(44),14,16,19,23(43),24,27,29,31,34,37,39,41-octadecaen-15-amine;3-fluoro-5-phenoxy-N,N-diphenylaniline;3-phenoxy-5-[3-[3-phenoxy-5-(N-phenylanilino)phenoxy]phenoxy]-N,N-diphenylaniline;15-N,15-N,25-N,25-N-tetraphenyl-12,18,28-trioxa-22-aza-1,5-diboranonacyclo[21.11.1.15,13.02,21.04,19.06,11.027,35.029,34.017,36]hexatriaconta-2,4(19),6,8,10,13(36),14,16,20,23(35),24,26,29,31,33-pentadecaene-15,25-diamine;bromide
CID 163925874
26-phenyl-32,36,42-trioxa-12,26-diaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2(35),3,6,8,10,13,15,17,20,22,24,27(50),28,30,33,37,39,41(49),43,45,47-henicosaene;32-phenyl-26,36,42-trioxa-12,32-diaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2(35),3,6,8,10,13,15,17,20,22,24,27,29,31(50),33,37,39,41(49),43,45,47-henicosaene;N,N,26,42-tetraphenyl-32,36-dioxa-12,26,42-triaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2,4(33),6,8,10,13,15,17,20,22,24,27(50),28,30,34,37,39,41(49),43,45,47-henicosaen-39-amine;bis(N,N,32,42-tetraphenyl-26,36-dioxa-12,32,42-triaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2(35),3,6,8,10,13,15,17,20,22,24,27,29,31(50),33,37,39,41(49),43,45,47-henicosaen-39-amine);26,36,42-triphenyl-32-oxa-12,26,36,42-tetraza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2,4(33),6,8,10,13,15,17,20,22,24,27(50),28,30,34,37,39,41(49),43,45,47-henicosaene;N,N,26-triphenyl-32,36,42-trioxa-12,26-diaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2(35),3,6,8,10,13,15,17,20,22,24,27(50),28,30,33,37,39,41(49),43,45,47-henicosaen-39-amine;N,N,32-triphenyl-26,36,42-trioxa-12,32-diaza-1,5,19-triboratridecacyclo[35.11.1.127,31.02,35.04,33.05,30.06,11.012,29.013,18.019,28.020,25.041,49.043,48]pentaconta-2(35),3,6,8,10,13,15,17,20,22,24,27,29,31(50),33,37,39,41(49),43,45,47-henicosaen-39-amine
CID 158529994
methane;9-N,9-N,19-N,19-N,16-pentakis-phenyl-5-[2,4,6-tri(propan-2-yl)phenyl]-12,22-dioxa-16-aza-1,5-diboraheptacyclo[15.11.1.02,15.04,13.06,11.021,29.023,28]nonacosa-2,4(13),6(11),7,9,14,17(29),18,20,23,25,27-dodecaene-9,19-diamine;3-N-[3-phenoxy-5-(N-phenylanilino)phenyl]-3-N,7-N,7-N-triphenyl-10-[2,4,6-tri(propan-2-yl)phenyl]benzo[b][1,4]benzoxaborinine-3,7-diamine
CID 165067009
15-N,15-N,25-N,25-N,12,18,22,38-octakis-phenyl-28,31-dioxa-12,18,22,38-tetraza-1,5-diboraundecacyclo[21.19.1.15,13.02,21.04,19.06,11.027,43.029,42.030,39.032,37.017,44]tetratetraconta-2(21),3,6,8,10,13(44),14,16,19,23(43),24,26,29(42),30(39),32,34,36,40-octadecaene-15,25-diamine
CID 163696611
15,21,41,48,54-pentakis-phenyl-35-oxa-15,21,41,48,54-pentaza-1,8,28-triborahexadecacyclo[47.11.1.18,16.128,36.02,47.04,45.05,24.07,22.09,14.025,44.027,42.029,34.053,61.055,60.020,63.040,62]trihexaconta-2,4,6,9,11,13,16(63),17,19,22,24,26,29,31,33,36,38,40(62),42,44,46,49,51,53(61),55,57,59-heptacosaene;15,35,41,48,54-pentakis-phenyl-21-oxa-15,35,41,48,54-pentaza-1,8,28-triborahexadecacyclo[47.11.1.18,16.128,36.02,47.04,45.05,24.07,22.09,14.025,44.027,42.029,34.053,61.055,60.020,63.040,62]trihexaconta-2,4,6,9,11,13,16(63),17,19,22,24,26,29,31,33,36(62),37,39,42,44,46,49,51,53(61),55,57,59-heptacosaene;13,36,48-triphenyl-7,42,54-trioxa-13,36,48-triaza-1,20,29-triborahexadecacyclo[47.11.1.18,12.129,37.02,47.04,45.05,24.06,21.014,19.025,44.028,43.030,35.053,61.055,60.020,63.041,62]trihexaconta-2,4,6(21),8,10,12(63),14,16,18,22,24,26,28(43),30,32,34,37(62),38,40,44,46,49(61),50,52,55,57,59-heptacosaene;15,41,48-triphenyl-21,35,54-trioxa-15,41,48-triaza-1,8,28-triborahexadecacyclo[47.11.1.18,16.128,36.02,47.04,45.05,24.07,22.09,14.025,44.027,42.029,34.053,61.055,60.020,63.040,62]trihexaconta-2,4,6,9,11,13,16(63),17,19,22,24,26,29,31,33,36,38,40(62),42,44,46,49(61),50,52,55,57,59-heptacosaene;15,41,54-triphenyl-21,35,48-trioxa-15,41,54-triaza-1,8,28-triborahexadecacyclo[47.11.1.18,16.128,36.02,47.04,45.05,24.07,22.09,14.025,44.027,42.029,34.053,61.055,60.020,63.040,62]trihexaconta-2,4(45),5(24),6,9,11,13,16(63),17,19,22,25(44),26,29,31,33,36,38,40(62),42,46,49,51,53(61),55,57,59-heptacosaene;21,41,48-triphenyl-15,35,54-trioxa-21,41,48-triaza-1,8,28-triborahexadecacyclo[47.11.1.18,16.128,36.02,47.04,45.05,24.07,22.09,14.025,44.027,42.029,34.053,61.055,60.020,63.040,62]trihexaconta-2,4,6,9,11,13,16,18,20(63),22,24,26,29,31,33,36,38,40(62),42,44,46,49(61),50,52,55,57,59-heptacosaene
CID 163782539
33-N,33-N,53-N,53-N,30,46,56-heptakis-phenyl-36,40,50-trioxa-12,30,46,56-tetraza-1,5,19,23-tetraboraheptadecacyclo[49.11.1.123,31.141,45.02,49.04,47.05,44.06,11.012,43.013,18.019,42.020,39.022,37.024,29.055,63.057,62.035,65]pentahexaconta-2(49),3,6,8,10,13,15,17,20(39),21,24,26,28,31(65),32,34,37,41,43,45(64),47,51,53,55(63),57,59,61-heptacosaene-33,53-diamine;16,22,46,50,56-pentakis-phenyl-40-oxa-12,16,22,46,50,56-hexaza-1,5,29,33-tetraboraheptadecacyclo[49.11.1.117,21.141,45.02,49.04,47.05,44.06,11.012,43.013,32.015,30.023,28.033,42.034,39.055,63.057,62.029,65]pentahexaconta-2,4(47),6,8,10,13(32),14,17,19,21(65),23,25,27,30,34,36,38,41,43,45(64),48,51,53,55(63),57,59,61-heptacosaene;33-N,33-N,53-N,53-N,46-pentakis-phenyl-30,36,40,50,56-pentaoxa-12,46-diaza-1,5,19,23-tetraboraheptadecacyclo[49.11.1.123,31.141,45.02,49.04,47.05,44.06,11.012,43.013,18.019,42.020,39.022,37.024,29.055,63.057,62.035,65]pentahexaconta-2(49),3,6,8,10,13,15,17,20,22(37),24,26,28,31(65),32,34,38,41,43,45(64),47,51,53,55(63),57,59,61-heptacosaene-33,53-diamine;46-phenyl-30,36,40,50,56-pentaoxa-12,46-diaza-1,5,19,23-tetraboraheptadecacyclo[49.11.1.123,31.141,45.02,49.04,47.05,44.06,11.012,43.013,18.019,42.020,39.022,37.024,29.055,63.057,62.035,65]pentahexaconta-2(49),3,6,8,10,13,15,17,20,22(37),24,26,28,31(65),32,34,38,41,43,45(64),47,51,53,55(63),57,59,61-heptacosaene
CID 158336597

Frequently Asked Questions

What is the IUPAC name of 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene?
The IUPAC name of 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene (CID 160706383) is 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene.
What is the SMILES notation for 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene?
The canonical SMILES for 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene is Brc1ccccc1Oc1cccc(Oc2ccccc2)c1.Oc1cccc(N(c2ccccc2)c2ccccc2)c1.Oc1cccc(Oc2ccccc2)c1.c1ccc(N2c3ccccc3B3c4ccc5c(c4Oc4cccc2c43)Oc2cccc3c2B5c2ccccc2O3)cc1.c1ccc(Oc2cccc(Oc3ccccc3Oc3cccc(N(c4ccccc4)c4ccccc4)c3)c2)cc1.
What is the InChIKey of 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene?
The InChIKey is RRGZARASSSWWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H21B2NO3.C36H27NO3.C18H13BrO2.C18H15NO.C12H10O2/c1-2-10-22(11-3-1)39-27-14-6-4-12-23(27)37-25-20-21-26-36(35(25)41-30-17-8-15-28(39)33(30)37)42-32-19-9-18-31-34(32)38(26)24-13-5-7-16-29(24)40-31;1-4-14-28(15-5-1)37(29-16-6-2-7-17-29)30-18-12-21-32(26-30)39-35-24-10-11-25-36(35)40-34-23-13-22-33(27-34)38-31-19-8-3-9-20-31;19-17-11-4-5-12-18(17)21-16-10-6-9-15(13-16)20-14-7-2-1-3-8-14;20-18-13-7-12-17(14-18)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16;13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-21H;1-27H;1-13H;1-14,20H;1-9,13H.
What are the key properties of 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene?
1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene has a molecular weight of 1847.55 g/mol, XLogP of 29.43, 19 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-2-(3-phenoxyphenoxy)benzene;3-phenoxyphenol;3-[2-(3-phenoxyphenoxy)phenoxy]-N,N-diphenylaniline;3-(N-phenylanilino)phenol;28-phenyl-13,19,22-trioxa-28-aza-1,6-diboranonacyclo[21.11.1.16,14.02,21.05,20.07,12.027,35.029,34.018,36]hexatriaconta-2(21),3,5(20),7,9,11,14(36),15,17,23,25,27(35),29,31,33-pentadecaene is sourced from PubChem (CID 160706383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).