benzyl[2-(dodecylamino)-2-oxoethyl]dimethylammonium chloride

Modify Date: 2025-08-20 08:51:01

benzyl[2-(dodecylamino)-2-oxoethyl]dimethylammonium chloride Structure
benzyl[2-(dodecylamino)-2-oxoethyl]dimethylammonium chloride structure
Common Name benzyl[2-(dodecylamino)-2-oxoethyl]dimethylammonium chloride
CAS Number 100-95-8 Molecular Weight 397.03700
Density N/A Boiling Point N/A
Molecular Formula C23H41ClN2O Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name benzyl-[2-(dodecylamino)-2-oxoethyl]-dimethylazanium,chloride
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C23H41ClN2O
Molecular Weight 397.03700
Exact Mass 396.29100
PSA 29.10000
LogP 2.69500
InChIKey COLOBWZNRYGBRU-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCNC(=O)C[N+](C)(C)Cc1ccccc1.[Cl-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BO7525000
CHEMICAL NAME :
Ammonium, benzyl((dodecylcarbamoyl)methyl)dimethyl-, chloride
CAS REGISTRY NUMBER :
100-95-8
LAST UPDATED :
199504
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C23-H41-N2-O.Cl
MOLECULAR WEIGHT :
397.11
WISWESSER LINE NOTATION :
12MV1K1&1&1R &G

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,536,1989 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M1166 No. of Facilities: 57 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 574 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - M1166 No. of Facilities: 130 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 2579 (estimated) No. of Female Employees: 1347 (estimated)

 Safety Information

RIDADR UN 2811
Packaging Group III
Hazard Class 6.1(b)
HS Code 2924299090

 Synthetic Route

~%

benzyl[2-(dodecylamino)-2-oxoethyl]dimethylammonium chloride Structure

benzyl[2-(dodec...

CAS#:100-95-8

Literature: Deutsche Hydrierwerke Patent: DE763310 , 1937 ; DRP/DRBP Org.Chem. Full Text Show Details Patchem A.G. Patent: US2295655 , 1938 ;

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2924299090
Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

Metalkonii chloridum
Urolocide
Quartolan
Straminol
Hydramon
Quartholite
Dodecarbonium chloride
Nopcoccide
Dodecarbonium
Metalkonium chloride
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