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16308-92-2 | Benzenemethanol, 2,4-dimethyl-
CAS No: 16308-92-2 Catalog No: AG001TO1 MDL No:MFCD00004624
Product Description
Catalog Number:
AG001TO1
Chemical Name:
Benzenemethanol, 2,4-dimethyl-
CAS Number:
16308-92-2
Molecular Formula:
C9H12O
Molecular Weight:
136.1910
MDL Number:
MFCD00004624
IUPAC Name:
(2,4-dimethylphenyl)methanol
InChI:
InChI=1S/C9H12O/c1-7-3-4-9(6-10)8(2)5-7/h3-5,10H,6H2,1-2H3
InChI Key:
QUIMJTKRVOBTQN-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1C)C
EC Number:
240-393-8
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.089g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.194g/mol
Monoisotopic Mass:
136.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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