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Home > Nitro Compounds > 99365-69-2
99365-69-2 | 7-Nitro-1,2,3,4-tetrahydroisoquinoline hydrochloride
CAS No: 99365-69-2 Catalog No: AG003NGN MDL No:MFCD07371494
Product Description
Catalog Number:
AG003NGN
Chemical Name:
7-Nitro-1,2,3,4-tetrahydroisoquinoline hydrochloride
CAS Number:
99365-69-2
Molecular Formula:
C9H11ClN2O2
Molecular Weight:
214.6488
MDL Number:
MFCD07371494
IUPAC Name:
7-nitro-1,2,3,4-tetrahydroisoquinoline;hydrochloride
InChI:
InChI=1S/C9H10N2O2.ClH/c12-11(13)9-2-1-7-3-4-10-6-8(7)5-9;/h1-2,5,10H,3-4,6H2;1H
InChI Key:
KGIXLJRTYZOUCW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)CNCC2.Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.649g/mol
Monoisotopic Mass:
214.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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