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1238324-73-6 | Carbamic acid, N-(2-chloro-4-formyl-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS No: 1238324-73-6 Catalog No: AG000L4Y MDL No:MFCD21365104
Product Description
Catalog Number:
AG000L4Y
Chemical Name:
Carbamic acid, N-(2-chloro-4-formyl-3-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
1238324-73-6
Molecular Formula:
C11H13ClN2O3
Molecular Weight:
256.6855
MDL Number:
MFCD21365104
IUPAC Name:
tert-butyl N-(2-chloro-4-formylpyridin-3-yl)carbamate
InChI:
InChI=1S/C11H13ClN2O3/c1-11(2,3)17-10(16)14-8-7(6-15)4-5-13-9(8)12/h4-6H,1-3H3,(H,14,16)
InChI Key:
DXOXSLQEUOMVTJ-UHFFFAOYSA-N
SMILES:
O=Cc1ccnc(c1NC(=O)OC(C)(C)C)Cl
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.061g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.686g/mol
Monoisotopic Mass:
256.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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