2-chloro-6-fluoro-3-methylbenzaldehyde

2-chloro-6-fluoro-3-methylbenzaldehyde

CAS: 104451-99-2

Formula: C8H6ClFO

SMILES: CC1=CC=C(F)C(C=O)=C1Cl

IUPAC: 2-chloro-6-fluoro-3-methylbenzaldehyde

InChI: InChI=1S/C8H6ClFO/c1-5-2-3-7(10)6(4-11)8(5)9/h2-4H,1H3

Composition: C (55.68%), H (3.50%), Cl (20.54%), F (11.01%), O (9.27%)

Molar Mass: 172.58

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	172.0091207
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	CSYKEPRGLYWJCW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.7
Topological Polar Surface Area	17.07
Polarizability	15.61
Ring Count	1
Rotatable Bond Count	1

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