(1R)-1-(3-chlorophenyl)propan-1-ol

C9H11ClO — CID 10920958

IUPAC(1R)-1-(3-chlorophenyl)propan-1-ol
SMILESCC[C@@H](O)c1cccc(Cl)c1
InChIInChI=1S/C9H11ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9,11H,2H2,1H3/t9-/m1/s1
InChIKeyAPYGJPRINQKIQF-SECBINFHSA-N
MW170.64 g/mol
LogP2.78
Rot. Bonds2

About (1R)-1-(3-chlorophenyl)propan-1-ol

(1R)-1-(3-chlorophenyl)propan-1-ol (PubChem CID 10920958) has the molecular formula C9H11ClO and a molecular weight of 170.64 g/mol. Its IUPAC name is (1R)-1-(3-chlorophenyl)propan-1-ol.

Molecular Properties

Compound Name(1R)-1-(3-chlorophenyl)propan-1-ol
PubChem CID10920958
Molecular FormulaC9H11ClO
Molecular Weight170.64 g/mol
Exact Mass170.05
IUPAC Name(1R)-1-(3-chlorophenyl)propan-1-ol
SMILESCC[C@@H](O)c1cccc(Cl)c1
InChIInChI=1S/C9H11ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9,11H,2H2,1H3/t9-/m1/s1
InChIKeyAPYGJPRINQKIQF-SECBINFHSA-N
XLogP2.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.64
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-chlorophenyl)propan-1-ol?
The IUPAC name of (1R)-1-(3-chlorophenyl)propan-1-ol (CID 10920958) is (1R)-1-(3-chlorophenyl)propan-1-ol.
What is the SMILES notation for (1R)-1-(3-chlorophenyl)propan-1-ol?
The canonical SMILES for (1R)-1-(3-chlorophenyl)propan-1-ol is CC[C@@H](O)c1cccc(Cl)c1.
What is the InChIKey of (1R)-1-(3-chlorophenyl)propan-1-ol?
The InChIKey is APYGJPRINQKIQF-SECBINFHSA-N. The full InChI is InChI=1S/C9H11ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9,11H,2H2,1H3/t9-/m1/s1.
What are the key properties of (1R)-1-(3-chlorophenyl)propan-1-ol?
(1R)-1-(3-chlorophenyl)propan-1-ol has a molecular weight of 170.64 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-chlorophenyl)propan-1-ol is sourced from PubChem (CID 10920958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).