Name: Name:2H-Tetrazole, 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-
Brand: AABLOCKS
SKU: AA0006A5
Rating: 90 (10 reviews)

Catalog No.:AA0006A5

1020248-97-8 | 2H-Tetrazole, 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-

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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA0006A5

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

Properties

Computed Properties

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

Synonyms

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

1020248-97-8

MFCD09163054

STL163651

ZINC10336262

AKOS002344245

MCULE-6999472135

Y-8275

5-(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)-2H-tetrazole

(2,2,2-TRIFLUORO-1-PHENYLETHOXY)ACETIC ACID

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

SCHEMBL12402291

CTK4A0560

DTXSID10654654

BB_SC-09303

ZX-CM006239

BBL019968

FCH933351

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