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1803600-77-2 | 6-(1H-1,2,3,4-tetrazol-5-yl)quinoline hydrochloride
CAS No: 1803600-77-2 Catalog No: AG01BGYL MDL No:MFCD28139441
Product Description
Catalog Number:
AG01BGYL
Chemical Name:
6-(1H-1,2,3,4-tetrazol-5-yl)quinoline hydrochloride
CAS Number:
1803600-77-2
Molecular Formula:
C10H8ClN5
Molecular Weight:
233.6570
MDL Number:
MFCD28139441
IUPAC Name:
6-(2H-tetrazol-5-yl)quinoline;hydrochloride
InChI:
InChI=1S/C10H7N5.ClH/c1-2-7-6-8(10-12-14-15-13-10)3-4-9(7)11-5-1;/h1-6H,(H,12,13,14,15);1H
InChI Key:
DOIMTERPLBNJFL-UHFFFAOYSA-N
SMILES:
n1nnc([nH]1)c1ccc2c(c1)cccn2.Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.047g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.659g/mol
Monoisotopic Mass:
233.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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