(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol

C10H13ClO — CID 93312224

IUPAC(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol
SMILESCC(C)[C@@H](O)c1cccc(Cl)c1
InChIInChI=1S/C10H13ClO/c1-7(2)10(12)8-4-3-5-9(11)6-8/h3-7,10,12H,1-2H3/t10-/m1/s1
InChIKeyQYOJXZSONXPFTR-SNVBAGLBSA-N
MW184.67 g/mol
LogP3.03
Rot. Bonds2

About (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol

(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol (PubChem CID 93312224) has the molecular formula C10H13ClO and a molecular weight of 184.67 g/mol. Its IUPAC name is (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol
PubChem CID93312224
Molecular FormulaC10H13ClO
Molecular Weight184.67 g/mol
Exact Mass184.07
IUPAC Name(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol
SMILESCC(C)[C@@H](O)c1cccc(Cl)c1
InChIInChI=1S/C10H13ClO/c1-7(2)10(12)8-4-3-5-9(11)6-8/h3-7,10,12H,1-2H3/t10-/m1/s1
InChIKeyQYOJXZSONXPFTR-SNVBAGLBSA-N
XLogP3.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.67
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2S)-2-amino-1-(3-chlorophenyl)propan-1-ol
CID 28743759
(1S,2S)-2-amino-1-(3-chlorophenyl)propan-1-ol
CID 28743755
(1S,2S)-1-(3-chlorophenyl)-2-(methylamino)propan-1-ol;hydrochloride
CID 175665348
3-(3-chlorophenyl)butan-2-ol
CID 66437186
2-amino-1-(3-chlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 123406451
(2R)-2-amino-1-(3-chlorophenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 89490748
1-(3-chlorophenyl)-2-methylsulfonylpropan-1-ol
CID 102550104
(3-chlorophenyl)methanediol
CID 20679602
1-bromo-1-(3-chlorophenyl)propan-2-ol
CID 150342170
(1S,2S)-1-(3-chlorophenyl)-2-(1-hydroxypropan-2-ylamino)propan-1-ol
CID 101431798
2-methyl-1-(3-propan-2-ylphenyl)propan-1-ol
CID 22486943
(1R,2R)-1-(3-chlorophenyl)-2-methoxypropane-1,3-diol
CID 124673100

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol?
The IUPAC name of (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol (CID 93312224) is (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol.
What is the SMILES notation for (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol?
The canonical SMILES for (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol is CC(C)[C@@H](O)c1cccc(Cl)c1.
What is the InChIKey of (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol?
The InChIKey is QYOJXZSONXPFTR-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H13ClO/c1-7(2)10(12)8-4-3-5-9(11)6-8/h3-7,10,12H,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol?
(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol has a molecular weight of 184.67 g/mol, XLogP of 3.03, 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)-2-methylpropan-1-ol is sourced from PubChem (CID 93312224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).