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6006-81-1 | beta-methylenephenethyl alcohol
CAS No: 6006-81-1 Catalog No: AG003651 MDL No:MFCD18827455
Product Description
Catalog Number:
AG003651
Chemical Name:
beta-methylenephenethyl alcohol
CAS Number:
6006-81-1
Molecular Formula:
C9H10O
Molecular Weight:
134.1751
MDL Number:
MFCD18827455
IUPAC Name:
2-phenylprop-2-en-1-ol
InChI:
InChI=1S/C9H10O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,10H,1,7H2
InChI Key:
BSZGXCFUKRLAAN-UHFFFAOYSA-N
SMILES:
OCC(=C)c1ccccc1
EC Number:
227-857-5
Properties
Complexity:
112
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:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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