(1R)-2-chloro-1-(3-chlorophenyl)ethanol

C8H8Cl2O — CID 10375278

IUPAC(1R)-2-chloro-1-(3-chlorophenyl)ethanol
SMILESO[C@@H](CCl)c1cccc(Cl)c1
InChIInChI=1S/C8H8Cl2O/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,8,11H,5H2/t8-/m0/s1
InChIKeyLBSKQOSGSUKVDG-QMMMGPOBSA-N
MW191.06 g/mol
LogP2.61
Rot. Bonds2

About (1R)-2-chloro-1-(3-chlorophenyl)ethanol

(1R)-2-chloro-1-(3-chlorophenyl)ethanol (PubChem CID 10375278) has the molecular formula C8H8Cl2O and a molecular weight of 191.06 g/mol. Its IUPAC name is (1R)-2-chloro-1-(3-chlorophenyl)ethanol.

Molecular Properties

Compound Name(1R)-2-chloro-1-(3-chlorophenyl)ethanol
PubChem CID10375278
Molecular FormulaC8H8Cl2O
Molecular Weight191.06 g/mol
Exact Mass190.00
IUPAC Name(1R)-2-chloro-1-(3-chlorophenyl)ethanol
SMILESO[C@@H](CCl)c1cccc(Cl)c1
InChIInChI=1S/C8H8Cl2O/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,8,11H,5H2/t8-/m0/s1
InChIKeyLBSKQOSGSUKVDG-QMMMGPOBSA-N
XLogP2.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.06
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-1-(3-chlorophenyl)propan-1-ol
CID 22621587
(3-chlorophenyl)methanediol
CID 20679602
2-chloro-1-(3-iodophenyl)ethanol
CID 18938569
3-(3-chlorophenyl)-3-hydroxypropanenitrile
CID 13004554
1-(3-chlorophenyl)-2-propan-2-ylsulfanylethanol
CID 65132101
2-amino-1-(3-chlorophenyl)ethanol;carbonic acid
CID 67865938
3-(3-chlorophenyl)-3-hydroxypropanoate
CID 19770450
2-(3-chlorophenoxy)-1-(3-chlorophenyl)ethanol
CID 115766354
(3-chlorophenyl)-fluoromethanol
CID 70239224
1-(3-chlorophenyl)-4-phenylbutan-1-ol
CID 55096467
2-(3-bromophenyl)-1-(3-chlorophenyl)ethanol
CID 60797873
(1S)-2-azido-1-(3-chlorophenyl)ethanol
CID 59761679

Frequently Asked Questions

What is the IUPAC name of (1R)-2-chloro-1-(3-chlorophenyl)ethanol?
The IUPAC name of (1R)-2-chloro-1-(3-chlorophenyl)ethanol (CID 10375278) is (1R)-2-chloro-1-(3-chlorophenyl)ethanol.
What is the SMILES notation for (1R)-2-chloro-1-(3-chlorophenyl)ethanol?
The canonical SMILES for (1R)-2-chloro-1-(3-chlorophenyl)ethanol is O[C@@H](CCl)c1cccc(Cl)c1.
What is the InChIKey of (1R)-2-chloro-1-(3-chlorophenyl)ethanol?
The InChIKey is LBSKQOSGSUKVDG-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H8Cl2O/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,8,11H,5H2/t8-/m0/s1.
What are the key properties of (1R)-2-chloro-1-(3-chlorophenyl)ethanol?
(1R)-2-chloro-1-(3-chlorophenyl)ethanol has a molecular weight of 191.06 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-chloro-1-(3-chlorophenyl)ethanol is sourced from PubChem (CID 10375278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).