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Home Halogens N-BOC 2-Acetyl-4-bromoaniline

N-BOC 2-Acetyl-4-bromoaniline

CAS No.:
341521-29-7
Catalog Number:
AG00I6QY
Molecular Formula:
C13H16BrNO3
Molecular Weight:
314.1750
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$350
- +
5g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG00I6QY
Chemical Name:
N-BOC 2-Acetyl-4-bromoaniline
CAS Number:
341521-29-7
Molecular Formula:
C13H16BrNO3
Molecular Weight:
314.1750
MDL Number:
MFCD18909632
IUPAC Name:
tert-butyl N-(2-acetyl-4-bromophenyl)carbamate
InChI:
InChI=1S/C13H16BrNO3/c1-8(16)10-7-9(14)5-6-11(10)15-12(17)18-13(2,3)4/h5-7H,1-4H3,(H,15,17)
InChI Key:
CCFLQYMUDYKGQO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cc1C(=O)C)Br
Properties
Complexity:
325  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.031g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
314.179g/mol
Monoisotopic Mass:
313.031g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties