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98400-69-2 | Carbamic acid, 4-pyridinyl-, 1,1-dimethylethyl ester
CAS No: 98400-69-2 Catalog No: AG00IK2R MDL No:MFCD02179232
Product Description
Catalog Number:
AG00IK2R
Chemical Name:
Carbamic acid, 4-pyridinyl-, 1,1-dimethylethyl ester
CAS Number:
98400-69-2
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD02179232
IUPAC Name:
tert-butyl N-pyridin-4-ylcarbamate
InChI:
InChI=1S/C10H14N2O2/c1-10(2,3)14-9(13)12-8-4-6-11-7-5-8/h4-7H,1-3H3,(H,11,12,13)
InChI Key:
DRZYCRFOGWMEES-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccncc1)OC(C)(C)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Selective and irreversible inhibitors of mosquito acetylcholinesterases for controlling malaria and other mosquito-borne diseases. | PloS one 20090101 |
| Dose responses of three 4-aminopyridine derivatives on axonal conduction in spinal cord trauma. | European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences 20060201 |
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