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89148-27-6 | Phenol, 4,4'-(1,3-butadiene-1,4-diyl)bis-
CAS No: 89148-27-6 Catalog No: AG003YSW MDL No:
Product Description
Catalog Number:
AG003YSW
Chemical Name:
Phenol, 4,4'-(1,3-butadiene-1,4-diyl)bis-
CAS Number:
89148-27-6
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
IUPAC Name:
4-[4-(4-hydroxyphenyl)buta-1,3-dienyl]phenol
InChI:
InChI=1S/C16H14O2/c17-15-9-5-13(6-10-15)3-1-2-4-14-7-11-16(18)12-8-14/h1-12,17-18H
InChI Key:
OOBJYHILDOBHJF-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C=CC=Cc1ccc(cc1)O
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.1
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