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248920-07-2 | Benzenemethanol, 2-methyl-6-(1-methylethyl)-
CAS No: 248920-07-2 Catalog No: AG002PRF MDL No:MFCD09999735
Product Description
Catalog Number:
AG002PRF
Chemical Name:
Benzenemethanol, 2-methyl-6-(1-methylethyl)-
CAS Number:
248920-07-2
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
MDL Number:
MFCD09999735
IUPAC Name:
(2-methyl-6-propan-2-ylphenyl)methanol
InChI:
InChI=1S/C11H16O/c1-8(2)10-6-4-5-9(3)11(10)7-12/h4-6,8,12H,7H2,1-3H3
InChI Key:
LSCGNXHUSRKGFR-UHFFFAOYSA-N
SMILES:
OCc1c(C)cccc1C(C)C
Properties
Complexity:
131
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:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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