Home Other Building Blocks 3-Cyanopropanoic acid

3-Cyanopropanoic acid

CAS No.:
16051-87-9
Catalog Number:
AG001RZN
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$70
- +
5g
96%
In Stock USA
United States
$233
- +
10g
96%
In Stock USA
United States
$373
- +
25g
96%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG001RZN
Chemical Name:
3-Cyanopropanoic acid
CAS Number:
16051-87-9
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
MDL Number:
MFCD00233974
IUPAC Name:
3-cyanopropanoic acid
InChI:
InChI=1S/C4H5NO2/c5-3-1-2-4(6)7/h1-2H2,(H,6,7)
InChI Key:
BXYQHDXDCJQOFD-UHFFFAOYSA-N
SMILES:
N#CCCC(=O)O
NSC Number:
97378
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.032g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
99.089g/mol
Monoisotopic Mass:
99.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
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Properties