(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol

C14H12Br2O2 — CID 11046931

IUPAC(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol
SMILESO[C@H](c1ccc(Br)cc1)[C@H](O)c1ccc(Br)cc1
InChIInChI=1S/C14H12Br2O2/c15-11-5-1-9(2-6-11)13(17)14(18)10-3-7-12(16)8-4-10/h1-8,13-14,17-18H/t13-,14-/m1/s1
InChIKeyGVQCDJVKPDOTCB-ZIAGYGMSSA-N
MW372.06 g/mol
LogP3.98
Rot. Bonds3

About (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol

(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol (PubChem CID 11046931) has the molecular formula C14H12Br2O2 and a molecular weight of 372.06 g/mol. Its IUPAC name is (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol.

Molecular Properties

Compound Name(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol
PubChem CID11046931
Molecular FormulaC14H12Br2O2
Molecular Weight372.06 g/mol
Exact Mass369.92
IUPAC Name(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol
SMILESO[C@H](c1ccc(Br)cc1)[C@H](O)c1ccc(Br)cc1
InChIInChI=1S/C14H12Br2O2/c15-11-5-1-9(2-6-11)13(17)14(18)10-3-7-12(16)8-4-10/h1-8,13-14,17-18H/t13-,14-/m1/s1
InChIKeyGVQCDJVKPDOTCB-ZIAGYGMSSA-N
XLogP3.98
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.06
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-[4-(4-bromophenyl)phenyl]-2,2-difluoroethanol
CID 15942068
1-(4-bromophenyl)-3-sulfanylpropane-1,2-diol
CID 170820927
(3R,4S)-4-(4-bromophenyl)-4-hydroxy-3-methylbutan-2-one
CID 129404262
1-(4-bromophenyl)-2-methylbut-3-en-1-ol
CID 14111207
4-amino-1-(4-bromophenyl)butane-1,2-diol
CID 171882308
4-[(4-bromophenyl)-hydroxymethyl]phenol
CID 146871813
(S)-(4-bromophenyl)-phenylmethanol
CID 778571
4-(4-bromophenyl)-3,4-dihydroxybutanamide
CID 171900225
1-[4-(1,2-dihydroxy-2-phenylethyl)phenyl]-2-phenylethane-1,2-diol
CID 14066931
(1S)-1-(4-bromophenyl)prop-2-en-1-ol
CID 25140431
[1-(4-bromophenyl)-1-hydroxypropan-2-yl] formate
CID 142779505
3-amino-4-(4-bromophenyl)-4-hydroxybutanoic acid
CID 82347872

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol?
The IUPAC name of (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol (CID 11046931) is (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol.
What is the SMILES notation for (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol?
The canonical SMILES for (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol is O[C@H](c1ccc(Br)cc1)[C@H](O)c1ccc(Br)cc1.
What is the InChIKey of (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol?
The InChIKey is GVQCDJVKPDOTCB-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H12Br2O2/c15-11-5-1-9(2-6-11)13(17)14(18)10-3-7-12(16)8-4-10/h1-8,13-14,17-18H/t13-,14-/m1/s1.
What are the key properties of (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol?
(1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol has a molecular weight of 372.06 g/mol, XLogP of 3.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-1,2-bis(4-bromophenyl)ethane-1,2-diol is sourced from PubChem (CID 11046931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).