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113575-82-9 | Phenol, 4-[methyl(1,2,3,4-tetrahydro-2-naphthalenyl)amino]-
CAS No: 113575-82-9 Catalog No: AG00091D MDL No:
Product Description
Catalog Number:
AG00091D
Chemical Name:
Phenol, 4-[methyl(1,2,3,4-tetrahydro-2-naphthalenyl)amino]-
CAS Number:
113575-82-9
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
4-[methyl(1,2,3,4-tetrahydronaphthalen-2-yl)amino]phenol
InChI:
InChI=1S/C17H19NO/c1-18(15-8-10-17(19)11-9-15)16-7-6-13-4-2-3-5-14(13)12-16/h2-5,8-11,16,19H,6-7,12H2,1H3
InChI Key:
NPJRWUYRUZSKMK-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)N(C1CCc2c(C1)cccc2)C
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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