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76044-36-5 | 5-Chloro-[1,2,4]triazolo[1,5-c]pyrimidine
CAS No: 76044-36-5 Catalog No: AG0058EW MDL No:MFCD09839072
Product Description
Catalog Number:
AG0058EW
Chemical Name:
5-Chloro-[1,2,4]triazolo[1,5-c]pyrimidine
CAS Number:
76044-36-5
Molecular Formula:
C5H3ClN4
Molecular Weight:
154.5571
MDL Number:
MFCD09839072
IUPAC Name:
5-chloro-[1,2,4]triazolo[1,5-c]pyrimidine
InChI:
InChI=1S/C5H3ClN4/c6-5-7-2-1-4-8-3-9-10(4)5/h1-3H
InChI Key:
DMBOZQIEVLAEOP-UHFFFAOYSA-N
SMILES:
Clc1nccc2n1ncn2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.005g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.557g/mol
Monoisotopic Mass:
154.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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