Home Halogens (2-Amino-4-bromo-6-methyl-phenyl)-carbamic acid tert-butyl ester

(2-Amino-4-bromo-6-methyl-phenyl)-carbamic acid tert-butyl ester

CAS No.:
1155949-16-8
Catalog Number:
AG00929Q
Molecular Formula:
C12H17BrN2O2
Molecular Weight:
301.1796
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Product Description
Catalog Number:
AG00929Q
Chemical Name:
(2-Amino-4-bromo-6-methyl-phenyl)-carbamic acid tert-butyl ester
CAS Number:
1155949-16-8
Molecular Formula:
C12H17BrN2O2
Molecular Weight:
301.1796
MDL Number:
MFCD12432556
IUPAC Name:
tert-butyl N-(2-amino-4-bromo-6-methylphenyl)carbamate
InChI:
InChI=1S/C12H17BrN2O2/c1-7-5-8(13)6-9(14)10(7)15-11(16)17-12(2,3)4/h5-6H,14H2,1-4H3,(H,15,16)
InChI Key:
RQUWGLIIOSNENW-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1c(C)cc(cc1N)Br
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.047g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
301.184g/mol
Monoisotopic Mass:
300.047g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties