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89659-71-2 | Carbamic acid, (2-amino-4-chlorophenyl)methyl-, ethyl ester
CAS No: 89659-71-2 Catalog No: AG0043UO MDL No:
Product Description
Catalog Number:
AG0043UO
Chemical Name:
Carbamic acid, (2-amino-4-chlorophenyl)methyl-, ethyl ester
CAS Number:
89659-71-2
Molecular Formula:
C10H13ClN2O2
Molecular Weight:
228.6754
IUPAC Name:
ethyl N-[(2-amino-4-chlorophenyl)methyl]carbamate
InChI:
InChI=1S/C10H13ClN2O2/c1-2-15-10(14)13-6-7-3-4-8(11)5-9(7)12/h3-5H,2,6,12H2,1H3,(H,13,14)
InChI Key:
IWALCISMKVPITN-UHFFFAOYSA-N
SMILES:
CCOC(=O)NCc1ccc(cc1N)Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.676g/mol
Monoisotopic Mass:
228.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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