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874194-25-9 | 1,4-Pentadien-3-ol, 4-methyl-1-phenyl-, (1E)-
CAS No: 874194-25-9 Catalog No: AG004GE4 MDL No:
Product Description
Catalog Number:
AG004GE4
Chemical Name:
1,4-Pentadien-3-ol, 4-methyl-1-phenyl-, (1E)-
CAS Number:
874194-25-9
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
IUPAC Name:
4-methyl-1-phenylpenta-1,4-dien-3-ol
InChI:
InChI=1S/C12H14O/c1-10(2)12(13)9-8-11-6-4-3-5-7-11/h3-9,12-13H,1H2,2H3
InChI Key:
ABTQZSDQHTVFAL-UHFFFAOYSA-N
SMILES:
OC(C(=C)C)/C=C/c1ccccc1
Properties
Complexity:
187
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:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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