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29473-85-6 | Carbamic acid, [4-(dimethylamino)-2-(1-naphthyl)butyl]-, ethyl ester (8CI)
CAS No: 29473-85-6 Catalog No: AG002YHQ MDL No:
Product Description
Catalog Number:
AG002YHQ
Chemical Name:
Carbamic acid, [4-(dimethylamino)-2-(1-naphthyl)butyl]-, ethyl ester (8CI)
CAS Number:
29473-85-6
Molecular Formula:
C19H26N2O2
Molecular Weight:
314.4219
IUPAC Name:
ethyl N-[4-(dimethylamino)-2-naphthalen-1-ylbutyl]carbamate
InChI:
InChI=1S/C19H26N2O2/c1-4-23-19(22)20-14-16(12-13-21(2)3)18-11-7-9-15-8-5-6-10-17(15)18/h5-11,16H,4,12-14H2,1-3H3,(H,20,22)
InChI Key:
QYNFRIYTQNQQGN-UHFFFAOYSA-N
SMILES:
CCOC(=O)NCC(c1cccc2c1cccc2)CCN(C)C
NSC Number:
171398
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.199g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.429g/mol
Monoisotopic Mass:
314.199g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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