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88725-08-0 | 2-Penten-3-ol, 4-chloro-
CAS No: 88725-08-0 Catalog No: AG00453G MDL No:
Product Description
Catalog Number:
AG00453G
Chemical Name:
2-Penten-3-ol, 4-chloro-
CAS Number:
88725-08-0
Molecular Formula:
C5H9ClO
Molecular Weight:
120.5774
IUPAC Name:
4-chloropent-2-en-3-ol
InChI:
InChI=1S/C5H9ClO/c1-3-5(7)4(2)6/h3-4,7H,1-2H3
InChI Key:
FIIYWPLYQZAWJS-UHFFFAOYSA-N
SMILES:
CC=C(C(Cl)C)O
Properties
Complexity:
78.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.034g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
120.576g/mol
Monoisotopic Mass:
120.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.5
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