Home Carboxys 2-carboxycinnamic acid

2-carboxycinnamic acid

CAS No.:
612-40-8
Catalog Number:
AG003GU0
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$100
- +
Product Description
Catalog Number:
AG003GU0
Chemical Name:
2-carboxycinnamic acid
CAS Number:
612-40-8
Molecular Formula:
C10H8O4
Molecular Weight:
192.1681
MDL Number:
MFCD00004380
IUPAC Name:
2-[(E)-2-carboxyethenyl]benzoic acid
InChI:
InChI=1S/C10H8O4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,11,12)(H,13,14)/b6-5+
InChI Key:
SCWPNMHQRGNQHH-AATRIKPKSA-N
SMILES:
OC(=O)/C=C/c1ccccc1C(=O)O
EC Number:
210-308-9
NSC Number:
16636
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.17g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties