sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 5-Amino-1-benzyl-1H-1,2,3-triazole-4-carboxylic acid

5-Amino-1-benzyl-1H-1,2,3-triazole-4-carboxylic acid

CAS No.:
25784-56-9
Catalog Number:
AG00C24W
Molecular Formula:
C10H10N4O2
Molecular Weight:
218.2120
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00C24W
Chemical Name:
5-Amino-1-benzyl-1H-1,2,3-triazole-4-carboxylic acid
CAS Number:
25784-56-9
Molecular Formula:
C10H10N4O2
Molecular Weight:
218.2120
MDL Number:
MFCD02219534
IUPAC Name:
5-amino-1-benzyltriazole-4-carboxylic acid
InChI:
InChI=1S/C10H10N4O2/c11-9-8(10(15)16)12-13-14(9)6-7-4-2-1-3-5-7/h1-5H,6,11H2,(H,15,16)
InChI Key:
BKIMAZAMIHCYRZ-UHFFFAOYSA-N
SMILES:
OC(=O)c1nnn(c1N)Cc1ccccc1
NSC Number:
14768
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.216g/mol
Monoisotopic Mass:
218.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties