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

Carbamic acid, N-(3-acetyl-2-pyrazinyl)-, 1,1-dimethylethyl ester

CAS No.:
1799412-29-5
Catalog Number:
AG0021GS
Molecular Formula:
C11H15N3O3
Molecular Weight:
237.2551
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Product Description
Catalog Number:
AG0021GS
Chemical Name:
Carbamic acid, N-(3-acetyl-2-pyrazinyl)-, 1,1-dimethylethyl ester
CAS Number:
1799412-29-5
Molecular Formula:
C11H15N3O3
Molecular Weight:
237.2551
MDL Number:
MFCD28963469
IUPAC Name:
tert-butyl N-(3-acetylpyrazin-2-yl)carbamate
InChI:
InChI=1S/C11H15N3O3/c1-7(15)8-9(13-6-5-12-8)14-10(16)17-11(2,3)4/h5-6H,1-4H3,(H,13,14,16)
InChI Key:
LTUDTDAIPWTWCO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1nccnc1C(=O)C
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.111g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.259g/mol
Monoisotopic Mass:
237.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties