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Structure

3-tert-Butyl-1H-pyrazole

CAS
15802-80-9
Catalog Number
ACM15802809
Category
Other Products
Molecular Weight
124.19
Molecular Formula
C7H12N2

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Specification

Synonyms
3(5)-t-Butylpyrazole, 3-tert-butyl-1H-pyrazole, Bionet2_000181, MolPort-002-344-063, MolPort-003-922-580, ZINC04002959, HMS1364I05, ALBB-005414, CID139978, STK503396, 3B-013, 15802-80-9, InChI=1/C7H12N2/c1-7(2,3)6-4-5-8-9-6/h4-5H,1-3H3,(H,8,9
IUPAC Name
5-tert-butyl-1H-pyrazole
Canonical SMILES
CC(C)(C)C1=CC=NN1
InChI Key
YIDCITOHTLPMMZ-UHFFFAOYSA-N
Boiling Point
219.1ºC at 760 mmHg
Flash Point
87.9ºC
Density
0.972g/cm³
Exact Mass
124.10000
H-Bond Acceptor
1
H-Bond Donor
1
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