5-(2-chloro-6-methylphenoxymethyl)furan-2-carbaldehyde

5-(2-chloro-6-methylphenoxymethyl)furan-2-carbaldehyde

CAS: 832737-46-9

Formula: C13H11ClO3

SMILES: CC1=C(OCC2=CC=C(O2)C=O)C(Cl)=CC=C1

IUPAC: 5-[(2-chloro-6-methylphenoxy)methyl]furan-2-carbaldehyde

InChI: InChI=1S/C13H11ClO3/c1-9-3-2-4-12(14)13(9)16-8-11-6-5-10(7-15)17-11/h2-7H,8H2,1H3

Composition: C (62.29%), H (4.42%), Cl (14.14%), O (19.15%)

Molar Mass: 250.68

Atom Count: 28

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	250.0396719
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	CUCYONZGTOHCOV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.83
Topological Polar Surface Area	39.44
Polarizability	24.88
Ring Count	2
Rotatable Bond Count	4

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