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53491-78-4 | 1-HYDRAZINYL-6,7-DIMETHOXYISOQUINOLINE
CAS No: 53491-78-4 Catalog No: AG01BWDB MDL No:MFCD22126083
Product Description
Catalog Number:
AG01BWDB
Chemical Name:
1-HYDRAZINYL-6,7-DIMETHOXYISOQUINOLINE
CAS Number:
53491-78-4
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
MDL Number:
MFCD22126083
IUPAC Name:
(6,7-dimethoxyisoquinolin-1-yl)hydrazine
InChI:
InChI=1S/C11H13N3O2/c1-15-9-5-7-3-4-13-11(14-12)8(7)6-10(9)16-2/h3-6H,12H2,1-2H3,(H,13,14)
InChI Key:
WNYKHAFFVWVQJF-UHFFFAOYSA-N
SMILES:
COc1cc2c(NN)nccc2cc1OC
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.244g/mol
Monoisotopic Mass:
219.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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