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879614-93-4 | tert-Butyl (5-amino-2-chlorophenyl)carbamate
CAS No: 879614-93-4 Catalog No: AG004G9M MDL No:MFCD04114551
Product Description
Catalog Number:
AG004G9M
Chemical Name:
tert-Butyl (5-amino-2-chlorophenyl)carbamate
CAS Number:
879614-93-4
Molecular Formula:
C11H15ClN2O2
Molecular Weight:
242.7020
MDL Number:
MFCD04114551
IUPAC Name:
tert-butyl N-(5-amino-2-chlorophenyl)carbamate
InChI:
InChI=1S/C11H15ClN2O2/c1-11(2,3)16-10(15)14-9-6-7(13)4-5-8(9)12/h4-6H,13H2,1-3H3,(H,14,15)
InChI Key:
FRDRXAUCXAXVHO-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(N)ccc1Cl)OC(C)(C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.082g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.703g/mol
Monoisotopic Mass:
242.082g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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