Home Other Building Blocks Carbamic acid, N-(3-ethyl-2-pyridinyl)-, 1,1-dimethylethyl ester

Carbamic acid, N-(3-ethyl-2-pyridinyl)-, 1,1-dimethylethyl ester

CAS No.:
149489-03-2
Catalog Number:
AG001LQT
Molecular Formula:
C12H18N2O2
Molecular Weight:
222.2835
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Product Description
Catalog Number:
AG001LQT
Chemical Name:
Carbamic acid, N-(3-ethyl-2-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number:
149489-03-2
Molecular Formula:
C12H18N2O2
Molecular Weight:
222.2835
MDL Number:
MFCD11976363
IUPAC Name:
tert-butyl N-(3-ethylpyridin-2-yl)carbamate
InChI:
InChI=1S/C12H18N2O2/c1-5-9-7-6-8-13-10(9)14-11(15)16-12(2,3)4/h6-8H,5H2,1-4H3,(H,13,14,15)
InChI Key:
IQRKFAYMMZQJCK-UHFFFAOYSA-N
SMILES:
CCc1cccnc1NC(=O)OC(C)(C)C
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.137g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.288g/mol
Monoisotopic Mass:
222.137g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties