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100281-12-7 | 1,5-Hexadien-3-ol, 4-methylene-
CAS No: 100281-12-7 Catalog No: AG0001H1 MDL No:
Product Description
Catalog Number:
AG0001H1
Chemical Name:
1,5-Hexadien-3-ol, 4-methylene-
CAS Number:
100281-12-7
Molecular Formula:
C7H10O
Molecular Weight:
110.1537
IUPAC Name:
4-methylidenehexa-1,5-dien-3-ol
InChI:
InChI=1S/C7H10O/c1-4-6(3)7(8)5-2/h4-5,7-8H,1-3H2
InChI Key:
MRKPMJITLYCLHK-UHFFFAOYSA-N
SMILES:
C=CC(=C)C(C=C)O
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
110.156g/mol
Monoisotopic Mass:
110.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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