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63321-54-0 | 4-nitrophenyl N-octylcarbamate
CAS No: 63321-54-0 Catalog No: AG00F5U1 MDL No:
Product Description
Catalog Number:
AG00F5U1
Chemical Name:
4-nitrophenyl N-octylcarbamate
CAS Number:
63321-54-0
IUPAC Name:
(4-nitrophenyl) N-octylcarbamate
InChI:
InChI=1S/C15H22N2O4/c1-2-3-4-5-6-7-12-16-15(18)21-14-10-8-13(9-11-14)17(19)20/h8-11H,2-7,12H2,1H3,(H,16,18)
InChI Key:
BHPTXUSQDRFHQA-UHFFFAOYSA-N
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.158g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.351g/mol
Monoisotopic Mass:
294.158g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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