Catalog No.:AA00ITEZ

1025166-12-4 | (2E)-3-[(2H-1,3-benzodioxol-5-yl)amino]-2-[(E)-2-chlorobenzoyl]prop-2-enenitrile

Name: Name:(2E)-3-[(2H-1,3-benzodioxol-5-yl)amino]-2-[(E)-2-chlorobenzoyl]prop-2-enenitrile
Brand: AABLOCKS
SKU: AA00ITEZ
Rating: 90 (10 reviews)

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA00ITEZ

Chemical Name:

(2E)-3-[(2H-1,3-benzodioxol-5-yl)amino]-2-[(E)-2-chlorobenzoyl]prop-2-enenitrile

CAS Number:

1025166-12-4

Molecular Formula:

C17H11ClN2O3

Molecular Weight:

326.7338

MDL Number:

MFCD01567557

SMILES:

N#C/C(=C\Nc1ccc2c(c1)OCO2)/C(=O)c1ccccc1Cl

Properties

Computed Properties

Complexity:

527

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3

Literature

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