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

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

CAS No.:
1394041-88-3
Catalog Number:
AG019ZYS
Molecular Formula:
C7H9N3O2
Molecular Weight:
167.1653
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Product Description
Catalog Number:
AG019ZYS
Chemical Name:
2-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)acetic acid
CAS Number:
1394041-88-3
Molecular Formula:
C7H9N3O2
Molecular Weight:
167.1653
MDL Number:
MFCD22375382
IUPAC Name:
2-(4-cyclopropyltriazol-1-yl)acetic acid
InChI:
InChI=1S/C7H9N3O2/c11-7(12)4-10-3-6(8-9-10)5-1-2-5/h3,5H,1-2,4H2,(H,11,12)
InChI Key:
PGGUTDRSAKTKPT-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1nnc(c1)C1CC1
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.168g/mol
Monoisotopic Mass:
167.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties