(2R)-2-chloro-2-phenylacetaldehyde

C8H7ClO — CID 92982743

IUPAC(2R)-2-chloro-2-phenylacetaldehyde
SMILESO=C[C@H](Cl)c1ccccc1
InChIInChI=1S/C8H7ClO/c9-8(6-10)7-4-2-1-3-5-7/h1-6,8H/t8-/m0/s1
InChIKeyRIGHPXPUHJFRHG-QMMMGPOBSA-N
MW154.60 g/mol
LogP2.17
Rot. Bonds2

About (2R)-2-chloro-2-phenylacetaldehyde

(2R)-2-chloro-2-phenylacetaldehyde (PubChem CID 92982743) has the molecular formula C8H7ClO and a molecular weight of 154.60 g/mol. Its IUPAC name is (2R)-2-chloro-2-phenylacetaldehyde.

Molecular Properties

Compound Name(2R)-2-chloro-2-phenylacetaldehyde
PubChem CID92982743
Molecular FormulaC8H7ClO
Molecular Weight154.60 g/mol
Exact Mass154.02
IUPAC Name(2R)-2-chloro-2-phenylacetaldehyde
SMILESO=C[C@H](Cl)c1ccccc1
InChIInChI=1S/C8H7ClO/c9-8(6-10)7-4-2-1-3-5-7/h1-6,8H/t8-/m0/s1
InChIKeyRIGHPXPUHJFRHG-QMMMGPOBSA-N
XLogP2.17
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(4-aminophenyl)-2-chloroacetaldehyde
CID 118438149
[(1R)-1-chloroprop-2-enyl]benzene
CID 94848346
1-chloroprop-2-enylbenzene
CID 11768772
4,4-dichloro-2-methyl-3-phenylbutanal
CID 11128135
CID 142097895
CID 142097895
(2S)-2-hydroxy-2-phenylacetaldehyde
CID 12536674
dichloromethylbenzene
CID 7411
2-methyl-3-phenylbutanal
CID 3024886
[chloro(phenyl)methyl]benzene;sulfane
CID 139508334
(Chlorobenzyl)silane
CID 23051080
CID 57277614
CID 57277614
2-chloro-2-[7-(1-chloro-2-oxoethyl)-9H-fluoren-2-yl]acetaldehyde
CID 123835336

Frequently Asked Questions

What is the IUPAC name of (2R)-2-chloro-2-phenylacetaldehyde?
The IUPAC name of (2R)-2-chloro-2-phenylacetaldehyde (CID 92982743) is (2R)-2-chloro-2-phenylacetaldehyde.
What is the SMILES notation for (2R)-2-chloro-2-phenylacetaldehyde?
The canonical SMILES for (2R)-2-chloro-2-phenylacetaldehyde is O=C[C@H](Cl)c1ccccc1.
What is the InChIKey of (2R)-2-chloro-2-phenylacetaldehyde?
The InChIKey is RIGHPXPUHJFRHG-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H7ClO/c9-8(6-10)7-4-2-1-3-5-7/h1-6,8H/t8-/m0/s1.
What are the key properties of (2R)-2-chloro-2-phenylacetaldehyde?
(2R)-2-chloro-2-phenylacetaldehyde has a molecular weight of 154.60 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-chloro-2-phenylacetaldehyde is sourced from PubChem (CID 92982743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).