5-chloro-2,3-dimethoxybenzaldehyde

5-chloro-2,3-dimethoxybenzaldehyde

CAS: 86232-28-2

Formula: C9H9ClO3

SMILES: COC1=CC(Cl)=CC(C=O)=C1OC

IUPAC: 5-chloro-2,3-dimethoxybenzaldehyde

InChI: InChI=1S/C9H9ClO3/c1-12-8-4-7(10)3-6(5-11)9(8)13-2/h3-5H,1-2H3

Composition: C (53.88%), H (4.52%), Cl (17.67%), O (23.92%)

Molar Mass: 200.62

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	200.0240218
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	FIRVUYUWCDJOMJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.37
Topological Polar Surface Area	35.53
Polarizability	19.19
Ring Count	1
Rotatable Bond Count	3

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