Home Other Building Blocks 1-[1-(azetidin-3-yl)-1H-1,2,3-triazol-4-yl]ethan-1-one hydrochloride

1-[1-(azetidin-3-yl)-1H-1,2,3-triazol-4-yl]ethan-1-one hydrochloride

CAS No.:
2126161-38-2
Catalog Number:
AG01EJVD
Molecular Formula:
C7H11ClN4O
Molecular Weight:
202.6414
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Product Description
Catalog Number:
AG01EJVD
Chemical Name:
1-[1-(azetidin-3-yl)-1H-1,2,3-triazol-4-yl]ethan-1-one hydrochloride
CAS Number:
2126161-38-2
Molecular Formula:
C7H11ClN4O
Molecular Weight:
202.6414
MDL Number:
MFCD31381191
IUPAC Name:
1-[1-(azetidin-3-yl)triazol-4-yl]ethanone;hydrochloride
InChI:
InChI=1S/C7H10N4O.ClH/c1-5(12)7-4-11(10-9-7)6-2-8-3-6;/h4,6,8H,2-3H2,1H3;1H
InChI Key:
SZLZNDFFJWZART-UHFFFAOYSA-N
SMILES:
CC(=O)c1nnn(c1)C1CNC1.Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.062g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
202.642g/mol
Monoisotopic Mass:
202.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties