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Merck
CN

87304

Tetrahexylammonium benzoate solution

~75% in methanol

Synonym(s):

THAB

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About This Item

Linear Formula:
[CH3(CH2)5]4N(C6H5COO)
CAS Number:
16436-29-6
Molecular Weight:
475.79
PubChem Substance ID:
57653237
UNSPSC Code:
12352116
Beilstein/REAXYS Number:
4084122
MDL number:
MFCD00041982

Key Documents

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SMILES string

[O-]C(=O)c1ccccc1.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC

InChI

1S/C24H52N.C7H6O2/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;8-7(9)6-4-2-1-3-5-6/h5-24H2,1-4H3;1-5H,(H,8,9)/q+1;/p-1

InChI key

PSEQWFPWQRZBOO-UHFFFAOYSA-M

concentration

~75% in methanol

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 2 - STOT SE 1

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

53.6 °F - closed cup

flash_point_c

12 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
274894/1

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