Home Other Building Blocks 4-CHLOROPENT-4-ENOIC ACID

4-CHLOROPENT-4-ENOIC ACID

CAS No.:
58435-01-1
Catalog Number:
AG01DWIH
Molecular Formula:
C5H7ClO2
Molecular Weight:
134.5609
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Product Description
Catalog Number:
AG01DWIH
Chemical Name:
4-CHLOROPENT-4-ENOIC ACID
CAS Number:
58435-01-1
Molecular Formula:
C5H7ClO2
Molecular Weight:
134.5609
MDL Number:
MFCD19229047
IUPAC Name:
4-chloropent-4-enoic acid
InChI:
InChI=1S/C5H7ClO2/c1-4(6)2-3-5(7)8/h1-3H2,(H,7,8)
InChI Key:
JOQXGZWETVCGRZ-UHFFFAOYSA-N
SMILES:
ClC(=C)CCC(=O)O
Properties
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.013g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
134.559g/mol
Monoisotopic Mass:
134.013g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties