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285984-35-2 | Carbamic acid, [4-[2-(4-morpholinyl)ethoxy]-1-naphthalenyl]-, 1,1-dimethylethyl ester (9CI)
CAS No: 285984-35-2 Catalog No: AG002VT7 MDL No:
Product Description
Catalog Number:
AG002VT7
Chemical Name:
Carbamic acid, [4-[2-(4-morpholinyl)ethoxy]-1-naphthalenyl]-, 1,1-dimethylethyl ester (9CI)
CAS Number:
285984-35-2
Molecular Formula:
C21H28N2O4
Molecular Weight:
372.4580
IUPAC Name:
tert-butyl N-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]carbamate
InChI:
InChI=1S/C21H28N2O4/c1-21(2,3)27-20(24)22-18-8-9-19(17-7-5-4-6-16(17)18)26-15-12-23-10-13-25-14-11-23/h4-9H,10-15H2,1-3H3,(H,22,24)
InChI Key:
XULLZLAGYGKKBS-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c2c1cccc2)OCCN1CCOCC1
Properties
Complexity:
473
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.205g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
372.465g/mol
Monoisotopic Mass:
372.205g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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