Home Other Building Blocks 2-(3-cyclopropyl-1-methyl-1H-1,2,4-triazol-5-yl)acetic acid

2-(3-cyclopropyl-1-methyl-1H-1,2,4-triazol-5-yl)acetic acid

CAS No.:
1343789-51-4
Catalog Number:
AG01C4JB
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01C4JB
Chemical Name:
2-(3-cyclopropyl-1-methyl-1H-1,2,4-triazol-5-yl)acetic acid
CAS Number:
1343789-51-4
MDL Number:
MFCD16859019
IUPAC Name:
2-(5-cyclopropyl-2-methyl-1,2,4-triazol-3-yl)acetic acid
InChI:
InChI=1S/C8H11N3O2/c1-11-6(4-7(12)13)9-8(10-11)5-2-3-5/h5H,2-4H2,1H3,(H,12,13)
InChI Key:
NYDJXTARNCUGMT-UHFFFAOYSA-N
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties