Home Aminos (2Z)-4-(cyclopropylamino)-4-oxobut-2-enoic acid

(2Z)-4-(cyclopropylamino)-4-oxobut-2-enoic acid

CAS No.:
27995-78-4
Catalog Number:
AG0167E6
Molecular Formula:
C7H9NO3
Molecular Weight:
155.1513
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG0167E6
Chemical Name:
(2Z)-4-(cyclopropylamino)-4-oxobut-2-enoic acid
CAS Number:
27995-78-4
Molecular Formula:
C7H9NO3
Molecular Weight:
155.1513
MDL Number:
MFCD11109078
IUPAC Name:
(Z)-4-(cyclopropylamino)-4-oxobut-2-enoic acid
InChI:
InChI=1S/C7H9NO3/c9-6(3-4-7(10)11)8-5-1-2-5/h3-5H,1-2H2,(H,8,9)(H,10,11)/b4-3-
InChI Key:
JRJTUGAKFMYQEE-ARJAWSKDSA-N
SMILES:
O=C(NC1CC1)/C=C\C(=O)O
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
155.058g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
155.153g/mol
Monoisotopic Mass:
155.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties