540846
2,2,3,3-Tetramethylbutane
≥94%
Synonym(s):
Hexamethylethane, NSC 62039
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About This Item
Linear Formula:
(CH3)3CC(CH3)3
CAS Number:
Molecular Weight:
114.23
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
209-855-6
MDL number:
Product Name
2,2,3,3-Tetramethylbutane, ≥94%
InChI key
OMMLUKLXGSRPHK-UHFFFAOYSA-N
InChI
1S/C8H18/c1-7(2,3)8(4,5)6/h1-6H3
SMILES string
CC(C)(C)C(C)(C)C
assay
≥94%
mp
94-97 °C (lit.)
Quality Level
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signalword
Danger
hcodes
Hazard Classifications
Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Central nervous system
Storage Class
3 - Flammable liquids
wgk
WGK 2
flash_point_f
39.2 °F - closed cup
flash_point_c
4 °C - closed cup
Regulatory Information
危险化学品
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Jeffrey A Manion et al.
The journal of physical chemistry. A, 119(28), 7637-7658 (2015-04-15)
Presented is a combined experimental and modeling study of the kinetics of the reactions of H and CH3 with n-butane, a representative aliphatic fuel. Abstraction of H from n-alkane fuels creates alkyl radicals that rapidly decompose at high temperatures to
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