Name: Name:t-Butyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate
Brand: Angene
SKU: AG000NUX
Rating: 90 (10 reviews)

t-Butyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate

CAS No.:

1255574-90-3

Catalog Number:

AG000NUX

Molecular Formula:

C12H13N3O4

Molecular Weight:

263.2493

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

98%

In Stock USA

United States

$75

- +

98%

In Stock USA

United States

$225

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Catalog Number:

AG000NUX

Chemical Name:

t-Butyl 2-cyano-2-(5-nitropyridin-2(1H)-ylidene)acetate

CAS Number:

1255574-90-3

Molecular Formula:

C12H13N3O4

Molecular Weight:

263.2493

MDL Number:

MFCD17214297

IUPAC Name:

tert-butyl (2E)-2-cyano-2-(5-nitro-1H-pyridin-2-ylidene)acetate

InChI:

InChI=1S/C12H13N3O4/c1-12(2,3)19-11(16)9(6-13)10-5-4-8(7-14-10)15(17)18/h4-5,7,14H,1-3H3/b10-9+

InChI Key:

GMFFWYZEYQEJDE-MDZDMXLPSA-N

SMILES:

N#CC(=c1ccc(c[nH]1)[N+](=O)[O-])C(=O)OC(C)(C)C

Complexity:

550

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

263.253g/mol

Monoisotopic Mass:

263.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

108A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7