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885270-70-2 | tert-Butyl (3-amino-4-bromophenyl)carbamate
CAS No: 885270-70-2 Catalog No: AG004772 MDL No:MFCD04114548
Product Description
Catalog Number:
AG004772
Chemical Name:
tert-Butyl (3-amino-4-bromophenyl)carbamate
CAS Number:
885270-70-2
Molecular Formula:
C11H15BrN2O2
Molecular Weight:
287.1530
MDL Number:
MFCD04114548
IUPAC Name:
tert-butyl N-(3-amino-4-bromophenyl)carbamate
InChI:
InChI=1S/C11H15BrN2O2/c1-11(2,3)16-10(15)14-7-4-5-8(12)9(13)6-7/h4-6H,13H2,1-3H3,(H,14,15)
InChI Key:
RFQBPWDUTRKBLH-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c(c1)N)Br
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.032g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.157g/mol
Monoisotopic Mass:
286.032g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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