3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol

C19H15BrO — CID 68526611

IUPAC3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol
SMILESCC1(C)c2ccccc2-c2c1cc(O)c1cc(Br)ccc21
InChIInChI=1S/C19H15BrO/c1-19(2)15-6-4-3-5-13(15)18-12-8-7-11(20)9-14(12)17(21)10-16(18)19/h3-10,21H,1-2H3
InChIKeyOYIWXRBEUOOQRY-UHFFFAOYSA-N
MW339.23 g/mol
LogP5.61
Rot. Bonds

About 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol

3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol (PubChem CID 68526611) has the molecular formula C19H15BrO and a molecular weight of 339.23 g/mol. Its IUPAC name is 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol.

Molecular Properties

Compound Name3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol
PubChem CID68526611
Molecular FormulaC19H15BrO
Molecular Weight339.23 g/mol
Exact Mass338.03
IUPAC Name3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol
SMILESCC1(C)c2ccccc2-c2c1cc(O)c1cc(Br)ccc21
InChIInChI=1S/C19H15BrO/c1-19(2)15-6-4-3-5-13(15)18-12-8-7-11(20)9-14(12)17(21)10-16(18)19/h3-10,21H,1-2H3
InChIKeyOYIWXRBEUOOQRY-UHFFFAOYSA-N
XLogP5.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.23
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

17-bromo-10,10-dimethyl-14,21-bis(4-phenylphenyl)pentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 58175387
1,3-dibromo-2,4-difluoro-7,7-dimethylbenzo[c]fluoren-5-ol
CID 141338587
5-iodo-7,7-dimethylbenzo[c]fluorene
CID 144938890
5-hydroxy-7,7-dimethylbenzo[g]fluorene-3,9-dicarbonitrile
CID 68530423
carbanide;bis(9,9-dimethylfluoren-4-ol);titanium(2+)
CID 59317562
2-bromo-7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 58939597
7,7-dimethyl-5-[10-(2,3,4,5,6-pentamethylphenyl)anthracen-9-yl]benzo[c]fluorene
CID 123260279
9,9-dimethylhexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3,5,7,11,13,15(23),16,18,20-undecaene
CID 58219949
3-methoxy-7,7,9-trimethylbenzo[c]fluoren-5-ol
CID 170123001
2-(9-bromo-7,7-dimethylbenzo[c]fluoren-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 143729801
(7,7-dimethylbenzo[c]fluoren-5-yl) acetate
CID 67171677
7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
CID 162712377

Frequently Asked Questions

What is the IUPAC name of 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol?
The IUPAC name of 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol (CID 68526611) is 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol.
What is the SMILES notation for 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol?
The canonical SMILES for 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol is CC1(C)c2ccccc2-c2c1cc(O)c1cc(Br)ccc21.
What is the InChIKey of 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol?
The InChIKey is OYIWXRBEUOOQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrO/c1-19(2)15-6-4-3-5-13(15)18-12-8-7-11(20)9-14(12)17(21)10-16(18)19/h3-10,21H,1-2H3.
What are the key properties of 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol?
3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol has a molecular weight of 339.23 g/mol, XLogP of 5.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-7,7-dimethylbenzo[c]fluoren-5-ol is sourced from PubChem (CID 68526611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).