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96333-04-9 | N0430hydrobromide
CAS No: 96333-04-9 Catalog No: AG01EQEM MDL No:
Product Description
Catalog Number:
AG01EQEM
Chemical Name:
N0430hydrobromide
CAS Number:
96333-04-9
IUPAC Name:
6-[methyl(prop-2-ynyl)amino]-5,6,7,8-tetrahydronaphthalene-1,2-diol;hydrobromide
InChI:
InChI=1S/C14H17NO2.BrH/c1-3-8-15(2)11-5-6-12-10(9-11)4-7-13(16)14(12)17;/h1,4,7,11,16-17H,5-6,8-9H2,2H3;1H
InChI Key:
YSACLFIXGKFEAM-UHFFFAOYSA-N
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.052g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
312.207g/mol
Monoisotopic Mass:
311.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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