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86251-93-6 | 4-Penten-1-ol, 4-methyl-3-methylene-
CAS No: 86251-93-6 Catalog No: AG004JRF MDL No:
Product Description
Catalog Number:
AG004JRF
Chemical Name:
4-Penten-1-ol, 4-methyl-3-methylene-
CAS Number:
86251-93-6
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
IUPAC Name:
4-methyl-3-methylidenepent-4-en-1-ol
InChI:
InChI=1S/C7H12O/c1-6(2)7(3)4-5-8/h8H,1,3-5H2,2H3
InChI Key:
GMKCZIDVGZGWIM-UHFFFAOYSA-N
SMILES:
CC(=C)C(=C)CCO
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.089g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.172g/mol
Monoisotopic Mass:
112.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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