Name: Name:Ethanone,1-(10,11-dihydro-3-nitro-5H-dibenz[b,f]azepin-5-yl)-
Brand: Angene
SKU: AG008LDL
Rating: 90 (10 reviews)

Ethanone,1-(10,11-dihydro-3-nitro-5H-dibenz[b,f]azepin-5-yl)-

CAS No.:

79752-03-7

Catalog Number:

AG008LDL

Molecular Formula:

C16H14N2O3

Molecular Weight:

282.2940

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Product Description

Catalog Number:

AG008LDL

Chemical Name:

Ethanone,1-(10,11-dihydro-3-nitro-5H-dibenz[b,f]azepin-5-yl)-

CAS Number:

79752-03-7

Molecular Formula:

C16H14N2O3

Molecular Weight:

282.2940

MDL Number:

MFCD01308819

IUPAC Name:

1-(2-nitro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone

InChI:

InChI=1S/C16H14N2O3/c1-11(19)17-15-5-3-2-4-12(15)6-7-13-8-9-14(18(20)21)10-16(13)17/h2-5,8-10H,6-7H2,1H3

InChI Key:

LZEJPLZDYOQHSM-UHFFFAOYSA-N

SMILES:

CC(=O)N1c2cc(ccc2CCc2c1cccc2)[N+](=O)[O-]

EC Number:

279-251-5

Properties

Complexity:

420

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

282.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.299g/mol

Monoisotopic Mass:

282.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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