3-chloro-4,5-difluorobenzaldehyde

3-chloro-4,5-difluorobenzaldehyde

CAS: 1261737-50-1

Formula: C7H3ClF2O

SMILES: FC1=C(F)C(Cl)=CC(C=O)=C1

IUPAC: 3-chloro-4,5-difluorobenzaldehyde

InChI: InChI=1S/C7H3ClF2O/c8-5-1-4(3-11)2-6(9)7(5)10/h1-3H

Composition: C (47.62%), H (1.71%), Cl (20.08%), F (21.52%), O (9.06%)

Molar Mass: 176.55

Atom Count: 14

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	175.9840487
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	HQSIMCODZRPQRV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.88
Topological Polar Surface Area	17.07
Polarizability	13.72
Ring Count	1
Rotatable Bond Count	1

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