Home Other Building Blocks Pent-4-enoic acid

Pent-4-enoic acid

CAS No.:
591-80-0
Catalog Number:
AG0037IP
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
1 week
United States
$9
- +
10g
98%
1 week
United States
$14
- +
Product Description
Catalog Number:
AG0037IP
Chemical Name:
Pent-4-enoic acid
CAS Number:
591-80-0
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
MDL Number:
MFCD00004408
IUPAC Name:
pent-4-enoic acid
InChI:
InChI=1S/C5H8O2/c1-2-3-4-5(6)7/h2H,1,3-4H2,(H,6,7)
InChI Key:
HVAMZGADVCBITI-UHFFFAOYSA-N
SMILES:
C=CCCC(=O)O
EC Number:
209-732-7
UNII:
D4S77Y29FB
FEMA Number:
2843
Properties
Complexity:
76.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
100.052g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
100.117g/mol
Monoisotopic Mass:
100.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
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Properties