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Home > Nitro Compounds > 77595-20-1
77595-20-1 | 3,4-dihydro-7-nitro-2H-pyrimido[2,1-b]benzothiazole hydrochloride
CAS No: 77595-20-1 Catalog No: AG00GPKL MDL No:
Product Description
Catalog Number:
AG00GPKL
Chemical Name:
3,4-dihydro-7-nitro-2H-pyrimido[2,1-b]benzothiazole hydrochloride
CAS Number:
77595-20-1
IUPAC Name:
7-nitro-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzothiazole;hydrochloride
InChI:
InChI=1S/C10H9N3O2S.ClH/c14-13(15)7-2-3-9-8(6-7)12-5-1-4-11-10(12)16-9;/h2-3,6H,1,4-5H2;1H
InChI Key:
GGDRKHGTDGUDRS-UHFFFAOYSA-N
EC Number:
278-732-7
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.018g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.719g/mol
Monoisotopic Mass:
271.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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