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88695-95-8 | 9-Phenanthrenamine, 3,4-dimethoxy-6-methyl-
CAS No: 88695-95-8 Catalog No: AG0047N3 MDL No:
Product Description
Catalog Number:
AG0047N3
Chemical Name:
9-Phenanthrenamine, 3,4-dimethoxy-6-methyl-
CAS Number:
88695-95-8
Molecular Formula:
C17H17NO2
Molecular Weight:
267.3224
IUPAC Name:
3,4-dimethoxy-6-methylphenanthren-9-amine
InChI:
InChI=1S/C17H17NO2/c1-10-4-6-12-13(8-10)16-11(9-14(12)18)5-7-15(19-2)17(16)20-3/h4-9H,18H2,1-3H3
InChI Key:
ARZYRECNZACJLE-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1OC)c1cc(C)ccc1c(c2)N
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.126g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.328g/mol
Monoisotopic Mass:
267.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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