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114915-58-1 | Benzenemethanol, 4-methyl-α-methylene-
CAS No: 114915-58-1 Catalog No: AG000FFR MDL No:
Product Description
Catalog Number:
AG000FFR
Chemical Name:
Benzenemethanol, 4-methyl-α-methylene-
CAS Number:
114915-58-1
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
IUPAC Name:
1-(4-methylphenyl)ethenol
InChI:
InChI=1S/C9H10O/c1-7-3-5-9(6-4-7)8(2)10/h3-6,10H,2H2,1H3
InChI Key:
WMYSAWDBBSUQBQ-UHFFFAOYSA-N
SMILES:
OC(=C)c1ccc(cc1)C
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.073g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.178g/mol
Monoisotopic Mass:
134.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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