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114467-66-2 | 2,5-Hexadien-1-ol, 4-phenyl-, (2E)-
CAS No: 114467-66-2 Catalog No: AG000EGK MDL No:
Product Description
Catalog Number:
AG000EGK
Chemical Name:
2,5-Hexadien-1-ol, 4-phenyl-, (2E)-
CAS Number:
114467-66-2
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
IUPAC Name:
4-phenylhexa-2,5-dien-1-ol
InChI:
InChI=1S/C12H14O/c1-2-11(9-6-10-13)12-7-4-3-5-8-12/h2-9,11,13H,1,10H2
InChI Key:
AFXATSGOIAVPTH-UHFFFAOYSA-N
SMILES:
OC/C=C/C(c1ccccc1)C=C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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