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1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate (1:1)

HCID 68650
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3006-10-8
Standard SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]
InChIKey
UUHBNESUDPIHCI-UHFFFAOYSA-M
Molecular formula
C20H44N.C2H5O4S
Average molar mass
423.7 g/mol
Monoisotopic mass
423.33823022

Names & identifiers

Preferred name
1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate (1:1)
IUPAC
ethyl-hexadecyl-dimethylazanium;ethyl sulfate
English name
Mecetronium ethylsulfate
Molecular formula
C22H49NO4S
Molecular weight
423.69

Names & synonyms

Mecetronium ethylsulfate3006-10-8Etilsulfato de mecetronioEtilsulfate de mecetroniumMecetronii etilsulfasEthylhexadecyldimethylammonium ethyl sulfateMecetronium etilsulphatemecetronium ethylsulphateCetylethyldimonium ethosulfateQM95LPV3CACetyl-ethyldimonium ethosulfateCETYL ETHYLDIMONIUM ETHOSULFATE
Show more names
Mexicam ethyl sulfateMecetronium EthosulfateMECETRONIUM ETHOSULPHATEcetyl-ethyl-dimethyl-ammoniumethyl-hexadecyl-dimethylazaniumethyl-hexadecyl-dimethyl-azaniumMecetronium ethyl sulphate (MES)Ethylhexadecyldimethylammonium ethylsulfate
DTXSID608839321-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate (1:1)RefChem:810816DTXCID501023410221-106-5Mecetronium etilsulfaten-ethyl-n,n-dimethylhexadecan-1-aminium ethyl sulfateethyl-hexadecyl-dimethylazanium;ethyl sulfate

Database identifiers

CAS
3006-10-8
PubChem CID
68650
DTXSID
DTXSID60883932
ChEMBL
CHEMBL2106839
UNII
QM95LPV3CA
EC Number
221-106-5

Properties

Computed structural properties

Topological polar surface area
74.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
17
Heavy atoms
28
Formal charge
0
Complexity
302

Physicochemical properties

Cosmetics Ingredients Functions
HAIR CONDITIONINGANTISTATIC
FDA UNII
95 LPV3CA · QM95LPV3CA
EPA Substance Registry System
1 · 1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate (3006-10-8)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 6 items

Danger

H314: Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P391, P405, and P501 (click each P-code to see the statement)

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Hazard information

Regulatory InformationChemical: 1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate
Hazard Classes and Categories · 4 items

Acute Tox. 4 (33.3%)

Skin corrosion - category 1

Skin corrosion/irritation - Category 1

Skin Corr. 1

Safety data

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319
Precautionary statements
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313

Chemistry & industry

Uses & manufacturing

General Manufacturing Information1-Hexadecanaminium, N-ethyl-N,N-dimethyl-, ethyl sulfate (1:1): ACTIVE

Applications

UsesAntiseptic agent

Suppliers42 total

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Hubei Lidu New Material Technology Co., Ltd+86-19307248857 +86-19307248857 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
湖北云镁科技有限公司027-59206672 18327059871 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉绿景丰华生物科技有限公司19972070065 · [email protected]
Jai Radhe Sales+(91)-(79)-26431096/65255722 · [email protected]
淄博容纳生物科技有限公司+86-86-13583358881 +8618560316533 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
武汉市承天精细化工有限公司18164098996 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
迪氏曼国际贸易(上海)有限公司021-67121166-834 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-15350571055 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
湖北拓邦化工有限公司027-59106185 13986192185 · [email protected]
重庆卡兰医药有限公司[email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
湖北诺纳科技有限公司027-59209883 17386169806 · [email protected]
天门恒昌化工有限公司027-59322316 15172518801 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
湖北实顺生物科技有限公司027-59223025 15107168801 · [email protected]

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Compound notes

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