Home Halogens tert-butyl N-{4-[1-(4-bromophenoxy)ethyl]phenyl}carbamate

tert-butyl N-{4-[1-(4-bromophenoxy)ethyl]phenyl}carbamate

CAS No.:
1864058-38-7
Catalog Number:
AG01AUNM
Molecular Formula:
C19H22BrNO3
Molecular Weight:
392.2869
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Product Description
Catalog Number:
AG01AUNM
Chemical Name:
tert-butyl N-{4-[1-(4-bromophenoxy)ethyl]phenyl}carbamate
CAS Number:
1864058-38-7
Molecular Formula:
C19H22BrNO3
Molecular Weight:
392.2869
MDL Number:
MFCD29041140
IUPAC Name:
tert-butyl N-[4-[1-(4-bromophenoxy)ethyl]phenyl]carbamate
InChI:
InChI=1S/C19H22BrNO3/c1-13(23-17-11-7-15(20)8-12-17)14-5-9-16(10-6-14)21-18(22)24-19(2,3)4/h5-13H,1-4H3,(H,21,22)
InChI Key:
VMZODJSVBNIWIK-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)NC(=O)OC(C)(C)C)Oc1ccc(cc1)Br
Properties
Complexity:
394  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.078g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
392.293g/mol
Monoisotopic Mass:
391.078g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties