Name: Name:1,3-Dimethyl 2-(3-nitropyridin-4-yl)propanedioate
Brand: Angene
SKU: AG00HYQ9
Rating: 90 (10 reviews)

1,3-Dimethyl 2-(3-nitropyridin-4-yl)propanedioate

CAS No.:

1621671-28-0

Catalog Number:

AG00HYQ9

Molecular Formula:

C10H10N2O6

Molecular Weight:

254.1962

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Purity

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Price(USD)

Quantity

97%

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United States

$438

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Catalog Number:

AG00HYQ9

Chemical Name:

1,3-Dimethyl 2-(3-nitropyridin-4-yl)propanedioate

CAS Number:

1621671-28-0

Molecular Formula:

C10H10N2O6

Molecular Weight:

254.1962

MDL Number:

MFCD30527686

IUPAC Name:

dimethyl 2-(3-nitropyridin-4-yl)propanedioate

InChI:

InChI=1S/C10H10N2O6/c1-17-9(13)8(10(14)18-2)6-3-4-11-5-7(6)12(15)16/h3-5,8H,1-2H3

InChI Key:

ABEKXTHLCPDVMX-UHFFFAOYSA-N

SMILES:

COC(=O)C(c1ccncc1[N+](=O)[O-])C(=O)OC

Complexity:

324

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.054g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.198g/mol

Monoisotopic Mass:

254.054g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

111A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6