Home Other Building Blocks [(2-carbamoylethyl)carbamoyl]formic acid

[(2-carbamoylethyl)carbamoyl]formic acid

CAS No.:
1153214-30-2
Catalog Number:
AG01ALY1
Molecular Formula:
C5H8N2O4
Molecular Weight:
160.1280
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Product Description
Catalog Number:
AG01ALY1
Chemical Name:
[(2-carbamoylethyl)carbamoyl]formic acid
CAS Number:
1153214-30-2
Molecular Formula:
C5H8N2O4
Molecular Weight:
160.1280
MDL Number:
MFCD12136731
IUPAC Name:
2-[(3-amino-3-oxopropyl)amino]-2-oxoacetic acid
InChI:
InChI=1S/C5H8N2O4/c6-3(8)1-2-7-4(9)5(10)11/h1-2H2,(H2,6,8)(H,7,9)(H,10,11)
InChI Key:
BKBGFROWRNXHBX-UHFFFAOYSA-N
SMILES:
NC(=O)CCNC(=O)C(=O)O
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
160.129g/mol
Monoisotopic Mass:
160.048g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7  
Properties