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144269-08-9 | 2-Cyclopenten-1-one, 5-(2-chloro-2-propen-1-yl)-4-hydroxy-
CAS No: 144269-08-9 Catalog No: AG001J7G MDL No:
Product Description
Catalog Number:
AG001J7G
Chemical Name:
2-Cyclopenten-1-one, 5-(2-chloro-2-propen-1-yl)-4-hydroxy-
CAS Number:
144269-08-9
Molecular Formula:
C8H9ClO2
Molecular Weight:
172.6089
IUPAC Name:
5-(2-chloroprop-2-enyl)-4-hydroxycyclopent-2-en-1-one
InChI:
InChI=1S/C8H9ClO2/c1-5(9)4-6-7(10)2-3-8(6)11/h2-3,6-7,10H,1,4H2
InChI Key:
AXITWVOXBYZURO-UHFFFAOYSA-N
SMILES:
ClC(=C)CC1C(O)C=CC1=O
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.029g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.608g/mol
Monoisotopic Mass:
172.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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