Name: Name:5-[(4-chlorophenoxy)methyl]-1H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01DW9N
Rating: 90 (10 reviews)

5-[(4-chlorophenoxy)methyl]-1H-1,2,3,4-tetrazole

CAS No.:

24896-24-0

Catalog Number:

AG01DW9N

Molecular Formula:

C8H7ClN4O

Molecular Weight:

210.6204

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Product Description

Catalog Number:

AG01DW9N

Chemical Name:

5-[(4-chlorophenoxy)methyl]-1H-1,2,3,4-tetrazole

CAS Number:

24896-24-0

Molecular Formula:

C8H7ClN4O

Molecular Weight:

210.6204

MDL Number:

MFCD06017316

IUPAC Name:

5-[(4-chlorophenoxy)methyl]-2H-tetrazole

InChI:

InChI=1S/C8H7ClN4O/c9-6-1-3-7(4-2-6)14-5-8-10-12-13-11-8/h1-4H,5H2,(H,10,11,12,13)

InChI Key:

LAEFYQOLGWVFTE-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)OCc1nnn[nH]1

Properties

Complexity:

175

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.621g/mol

Monoisotopic Mass:

210.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
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