Name: Name:2H-Tetrazole, 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-
Brand: Angene
SKU: AG0006CX
Rating: 90 (10 reviews)

2H-Tetrazole, 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-

CAS No.:

1020248-97-8

Catalog Number:

AG0006CX

Molecular Formula:

C6H7BrN6

Molecular Weight:

243.0640

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Purity

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United States

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Catalog Number:

AG0006CX

Chemical Name:

2H-Tetrazole, 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-

CAS Number:

1020248-97-8

Molecular Formula:

C6H7BrN6

Molecular Weight:

243.0640

MDL Number:

MFCD20502617

IUPAC Name:

5-(4-bromo-3,5-dimethylpyrazol-1-yl)-2H-tetrazole

InChI:

InChI=1S/C6H7BrN6/c1-3-5(7)4(2)13(10-3)6-8-11-12-9-6/h1-2H3,(H,8,9,11,12)

InChI Key:

BQDCYJGULMDRIX-UHFFFAOYSA-N

SMILES:

Cc1nn(c(c1Br)C)c1n[nH]nn1

Complexity:

190

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.992g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.068g/mol

Monoisotopic Mass:

241.992g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3