Home Halogens 4-[5-(chloromethyl)-1H-1,2,4-triazol-3-yl]pyrimidine hydrochloride

4-[5-(chloromethyl)-1H-1,2,4-triazol-3-yl]pyrimidine hydrochloride

CAS No.:
1803611-65-5
Catalog Number:
AG01B7WG
Molecular Formula:
C7H7Cl2N5
Molecular Weight:
232.0700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B7WG
Chemical Name:
4-[5-(chloromethyl)-1H-1,2,4-triazol-3-yl]pyrimidine hydrochloride
CAS Number:
1803611-65-5
Molecular Formula:
C7H7Cl2N5
Molecular Weight:
232.0700
MDL Number:
MFCD28246365
IUPAC Name:
4-[5-(chloromethyl)-1H-1,2,4-triazol-3-yl]pyrimidine;hydrochloride
InChI:
InChI=1S/C7H6ClN5.ClH/c8-3-6-11-7(13-12-6)5-1-2-9-4-10-5;/h1-2,4H,3H2,(H,11,12,13);1H
InChI Key:
YUKHOXCTXGXRQT-UHFFFAOYSA-N
SMILES:
ClCc1[nH]nc(n1)c1ccncn1.Cl
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.008g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
232.068g/mol
Monoisotopic Mass:
231.008g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties