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156365-94-5 | 3-Butene-1,2-diol, 2-phenyl-, (2R)-
CAS No: 156365-94-5 Catalog No: AG001OOZ MDL No:
Product Description
Catalog Number:
AG001OOZ
Chemical Name:
3-Butene-1,2-diol, 2-phenyl-, (2R)-
CAS Number:
156365-94-5
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
IUPAC Name:
(2R)-2-phenylbut-3-ene-1,2-diol
InChI:
InChI=1S/C10H12O2/c1-2-10(12,8-11)9-6-4-3-5-7-9/h2-7,11-12H,1,8H2/t10-/m0/s1
InChI Key:
TVMQAEKMPVGLHB-JTQLQIEISA-N
SMILES:
OC[C@](c1ccccc1)(C=C)O
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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