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Home Aminos 1-[4-(1-aminoethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide hydrochloride

1-[4-(1-aminoethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide hydrochloride

CAS No.:
1170384-79-8
Catalog Number:
AG019NCX
Molecular Formula:
C11H14ClN5O
Molecular Weight:
267.7148
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Product Description
Catalog Number:
AG019NCX
Chemical Name:
1-[4-(1-aminoethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide hydrochloride
CAS Number:
1170384-79-8
Molecular Formula:
C11H14ClN5O
Molecular Weight:
267.7148
MDL Number:
MFCD11505552
IUPAC Name:
1-[4-(1-aminoethyl)phenyl]triazole-4-carboxamide;hydrochloride
InChI:
InChI=1S/C11H13N5O.ClH/c1-7(12)8-2-4-9(5-3-8)16-6-10(11(13)17)14-15-16;/h2-7H,12H2,1H3,(H2,13,17);1H
InChI Key:
IFOULNKFPQRJAS-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)n1nnc(c1)C(=O)N)N.Cl
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.089g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
267.717g/mol
Monoisotopic Mass:
267.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties