Home Halogens Carbamic acid, [(4-chlorophenyl)methyl]-, 1,1-dimethylethyl ester

Carbamic acid, [(4-chlorophenyl)methyl]-, 1,1-dimethylethyl ester

CAS No.:
120157-95-1
Catalog Number:
AG00HF94
Molecular Formula:
C12H14ClD2NO2
Molecular Weight:
243.7263
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HF94
Chemical Name:
Carbamic acid, [(4-chlorophenyl)methyl]-, 1,1-dimethylethyl ester
CAS Number:
120157-95-1
Molecular Formula:
C12H14ClD2NO2
Molecular Weight:
243.7263
IUPAC Name:
tert-butyl N-[(4-chlorophenyl)methyl]carbamate
InChI:
InChI=1S/C12H16ClNO2/c1-12(2,3)16-11(15)14-8-9-4-6-10(13)7-5-9/h4-7H,8H2,1-3H3,(H,14,15)
InChI Key:
DWKFLKALAMAVJY-UHFFFAOYSA-N
SMILES:
C([2H])(c1ccc(cc1)Cl)(NC(=O)OC(C)(C)C)[2H]
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.087g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.715g/mol
Monoisotopic Mass:
241.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties