Phenol, 4-chloro-2-(1,1-dimethylethyl)-5-methyl-


Chemical Name: Phenol, 4-chloro-2-(1,1-dimethylethyl)-5-methyl-
CAS Number: 30894-16-7
Product Number: AG0031M1(AGN-PC-0JKOK8)
Synonyms:
MDL No:
Molecular Formula: C11H15ClO
Molecular Weight: 198.6892

Identification/Properties


Computed Properties
Molecular Weight:
198.69g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
198.081g/mol
Monoisotopic Mass:
198.081g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
173
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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