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2-chloro-3,5-dimethylphenol

2-chloro-3,5-dimethylphenol

CAS: 5538-41-0

Formula: C8H9ClO

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

IUPAC: 2-chloro-3,5-dimethylphenol

InChI: InChI=1S/C8H9ClO/c1-5-3-6(2)8(9)7(10)4-5/h3-4,10H,1-2H3

Composition: C (61.36%), H (5.79%), Cl (22.64%), O (10.22%)

Molar Mass: 156.61

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 156.0341926
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ZXPLGLMEXWSLCX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.93
Topological Polar Surface Area 20.23
Polarizability 16.34
Ring Count 1
Rotatable Bond Count 0

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