dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane

C35H31P — CID 166895339

IUPACdimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane
SMILESC=P(C)(C)c1ccc(-c2c3c(c(-c4ccc(-c5ccccc5)cc4)c4ccccc24)CCC=C3)cc1
InChIInChI=1S/C35H31P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-7,9-13,15-24H,1,8,14H2,2-3H3
InChIKeyVTMXSCKCCLOFJU-UHFFFAOYSA-N
MW482.61 g/mol
LogP9.13
Rot. Bonds4

About dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane

dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane (PubChem CID 166895339) has the molecular formula C35H31P and a molecular weight of 482.61 g/mol. Its IUPAC name is dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane.

Molecular Properties

Compound Namedimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane
PubChem CID166895339
Molecular FormulaC35H31P
Molecular Weight482.61 g/mol
Exact Mass482.22
IUPAC Namedimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane
SMILESC=P(C)(C)c1ccc(-c2c3c(c(-c4ccc(-c5ccccc5)cc4)c4ccccc24)CCC=C3)cc1
InChIInChI=1S/C35H31P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-7,9-13,15-24H,1,8,14H2,2-3H3
InChIKeyVTMXSCKCCLOFJU-UHFFFAOYSA-N
XLogP9.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.61
LogP ≤ 59.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9-(3-phenylphenyl)-10-[3-(3-phenylphenyl)phenyl]-1,2-dihydroanthracene
CID 144568833
dimethyl-methylidene-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-λ5-phosphane
CID 158473253
2-phenyl-8-(10-phenyl-3,4-dihydroanthracen-9-yl)dibenzothiophene
CID 155028360
10-methyl-9-(4-methylphenyl)-1,2-dihydroanthracene
CID 143123986
2-[10-(3,5-diphenylphenyl)-3,4-dihydroanthracen-9-yl]dibenzothiophene;ethane
CID 142424800
8,8,14,14-tetramethyl-5-phenyl-17-(10-phenyl-3,4-dihydroanthracen-9-yl)-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 70886167
8,8,14,14-tetramethyl-5-(10-phenylanthracen-9-yl)-17-(10-phenyl-1,2-dihydroanthracen-9-yl)-1-azahexacyclo[11.7.1.02,7.03,19.09,21.015,20]henicosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 89065329
2-methyl-1-phenyl-6-[4-(10-phenyl-1,2-dihydroanthracen-9-yl)phenyl]benzimidazole
CID 129305926
dimethyl-methylidene-(4-phenylphenyl)-λ5-phosphane
CID 59915525
9-phenyl-10-(4-phenyl-5,6-dihydronaphthalen-1-yl)anthracene
CID 164717350
9-phenyl-10-(4-phenyl-7,8-dihydronaphthalen-1-yl)anthracene
CID 145174557
1-methyl-7-(10-phenyl-1,2-dihydroanthracen-9-yl)-2-[(Z)-prop-1-enyl]dibenzofuran
CID 170225073

Frequently Asked Questions

What is the IUPAC name of dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane?
The IUPAC name of dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane (CID 166895339) is dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane.
What is the SMILES notation for dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane?
The canonical SMILES for dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane is C=P(C)(C)c1ccc(-c2c3c(c(-c4ccc(-c5ccccc5)cc4)c4ccccc24)CCC=C3)cc1.
What is the InChIKey of dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane?
The InChIKey is VTMXSCKCCLOFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H31P/c1-36(2,3)29-23-21-28(22-24-29)35-32-15-9-7-13-30(32)34(31-14-8-10-16-33(31)35)27-19-17-26(18-20-27)25-11-5-4-6-12-25/h4-7,9-13,15-24H,1,8,14H2,2-3H3.
What are the key properties of dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane?
dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane has a molecular weight of 482.61 g/mol, XLogP of 9.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-methylidene-[4-[10-(4-phenylphenyl)-3,4-dihydroanthracen-9-yl]phenyl]-λ5-phosphane is sourced from PubChem (CID 166895339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).