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6-chloronaphthalene-2-carboxylic acid

6-chloronaphthalene-2-carboxylic acid

CAS: 5042-97-7

Formula: C11H7ClO2

SMILES: OC(=O)C1=CC=C2C=C(Cl)C=CC2=C1

IUPAC: 6-chloronaphthalene-2-carboxylic acid

InChI: InChI=1S/C11H7ClO2/c12-10-4-3-7-5-9(11(13)14)2-1-8(7)6-10/h1-6H,(H,13,14)

Composition: C (63.94%), H (3.41%), Cl (17.16%), O (15.49%)

Molar Mass: 206.63

Atom Count: 21

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 206.0134572
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SRISHMVSUHENAI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.57
Topological Polar Surface Area 37.3
Polarizability 22.01
Ring Count 2
Rotatable Bond Count 1

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