Home Halogens tert-butyl N-(6-chloro-1,3-dioxaindan-5-yl)carbamate

tert-butyl N-(6-chloro-1,3-dioxaindan-5-yl)carbamate

CAS No.:
1485008-99-8
Catalog Number:
AG01C7CL
Molecular Formula:
C12H14ClNO4
Molecular Weight:
271.6969
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Product Description
Catalog Number:
AG01C7CL
Chemical Name:
tert-butyl N-(6-chloro-1,3-dioxaindan-5-yl)carbamate
CAS Number:
1485008-99-8
Molecular Formula:
C12H14ClNO4
Molecular Weight:
271.6969
MDL Number:
MFCD21170058
IUPAC Name:
tert-butyl N-(6-chloro-1,3-benzodioxol-5-yl)carbamate
InChI:
InChI=1S/C12H14ClNO4/c1-12(2,3)18-11(15)14-8-5-10-9(4-7(8)13)16-6-17-10/h4-5H,6H2,1-3H3,(H,14,15)
InChI Key:
NOGDJVMCZLLCKF-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc2OCOc2cc1Cl)OC(C)(C)C
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.061g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
271.697g/mol
Monoisotopic Mass:
271.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties