Catalog No.:AA000CRI

116598-69-7 | (6,7,8,9-Tetrahydro-5h-[1,2,4]triazolo[4,3-a]azepin-3-yl)-acetonitrile

Name: Name:(6,7,8,9-Tetrahydro-5h-[1,2,4]triazolo[4,3-a]azepin-3-yl)-acetonitrile
Brand: AABLOCKS
SKU: AA000CRI
Availability: InStock
Rating: 90 (10 reviews)

Pack Size

Purity

Availability

Price(USD)

Quantity

98%

in stock

$278.00 $195.00

- +

98%

in stock

$809.00 $567.00

- +

10g

98%

in stock

$1,208.00 $846.00

- +

Technical Information
Properties
Downstream Synthesis Route
Literature
Request for Quotation
Download SDS

Technical Information
Properties
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA000CRI

Chemical Name:

(6,7,8,9-Tetrahydro-5h-[1,2,4]triazolo[4,3-a]azepin-3-yl)-acetonitrile

CAS Number:

116598-69-7

Molecular Formula:

C9H12N4

Molecular Weight:

176.2184

MDL Number:

MFCD00980781

SMILES:

N#CCc1nnc2n1CCCCC2

Properties

Computed Properties

Complexity:

219

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Rotatable Bond Count:

XLogP3:

0.2

Downstream Synthesis Route

2525-16-8

140-87-4

116598-69-7

[1]RussianChemicalBulletin,2006,vol.55,p.1636-1641

[2]ChemischeBerichte,1957,vol.90,p.909,818

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Quotation Request

Company Name:

Contact Person:

Email:

Quantity Required:

Country:

Additional Info:

SDS