Home Aminos tert-butyl N-(2-amino-5-cyanophenyl)carbamate

tert-butyl N-(2-amino-5-cyanophenyl)carbamate

CAS No.:
1824298-66-9
Catalog Number:
AG01BV78
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
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Product Description
Catalog Number:
AG01BV78
Chemical Name:
tert-butyl N-(2-amino-5-cyanophenyl)carbamate
CAS Number:
1824298-66-9
Molecular Formula:
C12H15N3O2
Molecular Weight:
233.2664
MDL Number:
MFCD09835459
IUPAC Name:
tert-butyl N-(2-amino-5-cyanophenyl)carbamate
InChI:
InChI=1S/C12H15N3O2/c1-12(2,3)17-11(16)15-10-6-8(7-13)4-5-9(10)14/h4-6H,14H2,1-3H3,(H,15,16)
InChI Key:
XHPKRHHURHVQFW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)NC(=O)OC(C)(C)C)N
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.116g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.271g/mol
Monoisotopic Mass:
233.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties