Home Other Building Blocks (2Z)-3-(dimethylcarbamoyl)prop-2-enoic acid, Z

(2Z)-3-(dimethylcarbamoyl)prop-2-enoic acid, Z

CAS No.:
2564-94-5
Catalog Number:
AG01BTQW
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
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Product Description
Catalog Number:
AG01BTQW
Chemical Name:
(2Z)-3-(dimethylcarbamoyl)prop-2-enoic acid, Z
CAS Number:
2564-94-5
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
MDL Number:
MFCD07528351
IUPAC Name:
4-(dimethylamino)-4-oxobut-2-enoic acid
InChI:
InChI=1S/C6H9NO3/c1-7(2)5(8)3-4-6(9)10/h3-4H,1-2H3,(H,9,10)
InChI Key:
UWVCKXVPDINNHW-UHFFFAOYSA-N
SMILES:
CN(C(=O)/C=C\C(=O)O)C
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.058g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.142g/mol
Monoisotopic Mass:
143.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
-0.5  
Properties