3-Chloro-3-(3-pyridinyl)-2-propenal

HCID 53869734
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Basic information

Standard SMILES
O=CC=C(Cl)c1cccnc1
InChIKey
HCHAABAWDWGELE-UHFFFAOYSA-N
Molecular formula
C8H6ClNO
Average molar mass
167.59 g/mol
Monoisotopic mass
167.0137915

Names & identifiers

Preferred name
3-Chloro-3-(3-pyridinyl)-2-propenal
IUPAC
3-chloro-3-pyridin-3-ylprop-2-enal

Names & synonyms

(Z)-3-Chloro-3-(3-pyridinyl)-2-propenalSCHEMBL7363560HCHAABAWDWGELE-UHFFFAOYSA-N3-chloro-3-(3-pyridinyl)-2-propenal

Database identifiers

PubChem CID
53869734

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
30 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

Related reactions

2 records
New reaction record

Compound notes

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