Home Carboxys 2-amino-1-ethyl-1H-1,3-benzodiazole-5-carboxylic acid

2-amino-1-ethyl-1H-1,3-benzodiazole-5-carboxylic acid

CAS No.:
1424269-13-5
Catalog Number:
AG01A3E2
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A3E2
Chemical Name:
2-amino-1-ethyl-1H-1,3-benzodiazole-5-carboxylic acid
CAS Number:
1424269-13-5
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
MDL Number:
MFCD20038979
IUPAC Name:
2-amino-1-ethylbenzimidazole-5-carboxylic acid
InChI:
InChI=1S/C10H11N3O2/c1-2-13-8-4-3-6(9(14)15)5-7(8)12-10(13)11/h3-5H,2H2,1H3,(H2,11,12)(H,14,15)
InChI Key:
BTCQOKLMQNPBKN-UHFFFAOYSA-N
SMILES:
CCn1c(N)nc2c1ccc(c2)C(=O)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.217g/mol
Monoisotopic Mass:
205.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties