Name: Name:3-[(2-Amino-5-nitrophenyl)amino]cyclohex-2-en-1-one
Brand: Angene
SKU: AG01EXX3
Rating: 90 (10 reviews)

3-[(2-Amino-5-nitrophenyl)amino]cyclohex-2-en-1-one

CAS No.:

865073-48-9

Catalog Number:

AG01EXX3

Molecular Formula:

C12H13N3O3

Molecular Weight:

247.2499

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

100mg

tech

1 week

United States

$330

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Catalog Number:

AG01EXX3

Chemical Name:

3-[(2-Amino-5-nitrophenyl)amino]cyclohex-2-en-1-one

CAS Number:

865073-48-9

Molecular Formula:

C12H13N3O3

Molecular Weight:

247.2499

MDL Number:

MFCD06762792

IUPAC Name:

3-(2-amino-5-nitroanilino)cyclohex-2-en-1-one

InChI:

InChI=1S/C12H13N3O3/c13-11-5-4-9(15(17)18)7-12(11)14-8-2-1-3-10(16)6-8/h4-7,14H,1-3,13H2

InChI Key:

YJRONFSEJIWTSP-UHFFFAOYSA-N

SMILES:

O=C1CCCC(=C1)Nc1cc(ccc1N)[N+](=O)[O-]

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.096g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.254g/mol

Monoisotopic Mass:

247.096g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

101A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3