Home Other Building Blocks 2-(2,4-dioxo-1,3-diazinan-1-yl)acetic acid

2-(2,4-dioxo-1,3-diazinan-1-yl)acetic acid

CAS No.:
1311314-41-6
Catalog Number:
AG01AH7J
Molecular Formula:
C6H8N2O4
Molecular Weight:
172.1387
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AH7J
Chemical Name:
2-(2,4-dioxo-1,3-diazinan-1-yl)acetic acid
CAS Number:
1311314-41-6
Molecular Formula:
C6H8N2O4
Molecular Weight:
172.1387
MDL Number:
MFCD18483233
IUPAC Name:
2-(2,4-dioxo-1,3-diazinan-1-yl)acetic acid
InChI:
InChI=1S/C6H8N2O4/c9-4-1-2-8(3-5(10)11)6(12)7-4/h1-3H2,(H,10,11)(H,7,9,12)
InChI Key:
OPTZZLGXCKKKNR-UHFFFAOYSA-N
SMILES:
OC(=O)CN1CCC(=O)NC1=O
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.14g/mol
Monoisotopic Mass:
172.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  
Properties