Home Other Building Blocks 3-(Prop-2-yn-1-ylcarbamoyl)acrylic acid

3-(Prop-2-yn-1-ylcarbamoyl)acrylic acid

CAS No.:
671188-20-8
Catalog Number:
AG00G1J1
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00G1J1
Chemical Name:
3-(Prop-2-yn-1-ylcarbamoyl)acrylic acid
CAS Number:
671188-20-8
MDL Number:
MFCD00111718
IUPAC Name:
(E)-4-oxo-4-(prop-2-ynylamino)but-2-enoic acid
InChI:
InChI=1S/C7H7NO3/c1-2-5-8-6(9)3-4-7(10)11/h1,3-4H,5H2,(H,8,9)(H,10,11)/b4-3+
InChI Key:
HALRXTZFQAPCDC-ONEGZZNKSA-N
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
153.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
153.137g/mol
Monoisotopic Mass:
153.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties