Catalog No.:AA00IDNY

856863-09-7 | (2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid

Name: Name:(2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid
Brand: AABLOCKS
SKU: AA00IDNY
Rating: 90 (10 reviews)

This product is typically in stock,please click "Inquire" below or
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Technical Information

Catalog Number:

AA00IDNY

Chemical Name:

(2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid

CAS Number:

856863-09-7

Molecular Formula:

C12H11N3O2

Molecular Weight:

229.2346

MDL Number:

MFCD07346277

SMILES:

OC(=O)/C=C/c1nnn(c1)Cc1ccccc1

Properties

Computed Properties

Complexity:

288

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3

Literature

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Tags:856863-09-7 Molecular Formula|856863-09-7 MDL|856863-09-7 SMILES|856863-09-7 (2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid

Catalog No.: AA00IDNY

856863-09-7 | (2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid

This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.

Inquire

Technical Information

Catalog Number: AA00IDNY

Chemical Name: (2E)-3-(1-Benzyl-1h-1,2,3-triazol-4-yl)acrylic acid

CAS Number: 856863-09-7

Molecular Formula: C12H11N3O2

Molecular Weight: 229.2346

MDL Number: MFCD07346277

SMILES: OC(=O)/C=C/c1nnn(c1)Cc1ccccc1

Properties

Complexity: 288

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 1

Formal Charge: 0

Heavy Atom Count: 17

Hydrogen Bond Acceptor Count: 4

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 4

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.3

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