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137321-72-3 | Phenol, 2,3-dimethyl-6-(1-methylethyl)-
CAS No: 137321-72-3 Catalog No: AG00133Y MDL No:
Product Description
Catalog Number:
AG00133Y
Chemical Name:
Phenol, 2,3-dimethyl-6-(1-methylethyl)-
CAS Number:
137321-72-3
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
2,3-dimethyl-6-propan-2-ylphenol
InChI:
InChI=1S/C11H16O/c1-7(2)10-6-5-8(3)9(4)11(10)12/h5-7,12H,1-4H3
InChI Key:
DTCVWQAPCDRBKX-UHFFFAOYSA-N
SMILES:
CC(c1ccc(c(c1O)C)C)C
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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