METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE

Modify Date: 2024-01-14 15:31:33

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure
METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE structure
 Common Name METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE
CAS Number 91012-53-2 Molecular Weight 195.21500
Density 1.123g/cm3 Boiling Point 277ºC at 760 mmHg
Molecular Formula C10H13NO3 Melting Point N/A
MSDS N/A Flash Point 121.3ºC

 Names

Name (n-methoxy-n-methylcarbamoylmethyl)phenoxymethane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.123g/cm3
Boiling Point 277ºC at 760 mmHg
Molecular Formula C10H13NO3
Molecular Weight 195.21500
Flash Point 121.3ºC
Exact Mass 195.09000
PSA 38.77000
LogP 1.08520
Index of Refraction 1.514

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AK8357000
CHEMICAL NAME :
Acetohydroxamic acid, N,O-dimethyl-2-phenoxy-
CAS REGISTRY NUMBER :
91012-53-2
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C10-H13-N-O3
MOLECULAR WEIGHT :
195.24
WISWESSER LINE NOTATION :
1ON1&V1OR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2370 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,317,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1065 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,317,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
361 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
REFERENCE :
JMPCAS Journal of Medicinal and Pharmaceutical Chemistry. (Washington, DC) V.1-5, 1959-62. For publisher information, see JMCMAR. Volume(issue)/page/year: 4,317,1961

 Safety Information

HS Code 2924299090

 Synthetic Route

N,O-Dimethylhydroxylamine hydrochloride structure

N,O-Dimethylhyd...

CAS#:6638-79-5

Phenoxyacetic acid structure

Phenoxyacetic acid

CAS#:122-59-8

~89%

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure

METHYL3-AMINO-4...

CAS#:91012-53-2

Literature: NORTH CAROLINA STATE UNIVERSITY; LINDSEY, Jonathan S.; MASS, Olga Patent: WO2013/62670 A2, 2013 ; Location in patent: Page/Page column 79 ;
N,O-Dimethylhydroxylamine hydrochloride structure

N,O-Dimethylhyd...

CAS#:6638-79-5

Phenoxyacetyl chloride structure

Phenoxyacetyl c...

CAS#:701-99-5

~81%

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure

METHYL3-AMINO-4...

CAS#:91012-53-2

Literature: Hiyama; Reddy; Minami; Hanamoto Bulletin of the Chemical Society of Japan, 1995 , vol. 68, # 1 p. 350 - 363
N,O-Dimethylhydroxylamine hydrochloride structure

N,O-Dimethylhyd...

CAS#:6638-79-5

1-(phenoxyacetyl)-1H-imidazole structure

1-(phenoxyacety...

CAS#:110009-60-4

~%

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure

METHYL3-AMINO-4...

CAS#:91012-53-2

Literature: Mass, Olga; Lindsey, Jonathan S. Journal of Organic Chemistry, 2011 , vol. 76, # 22 p. 9478 - 9487
Phenoxyacetic acid structure

Phenoxyacetic acid

CAS#:122-59-8

~%

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure

METHYL3-AMINO-4...

CAS#:91012-53-2

Literature: Major,R.T.; Ohly,K.W. J. Med. Pharm. Chem., 1961 , vol. 4, # 2 p. 317 - 326
Phenoxyacetyl chloride structure

Phenoxyacetyl c...

CAS#:701-99-5

N-methoxymethanamine structure

N-methoxymethanamine

CAS#:1117-97-1

~%

METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE Structure

METHYL3-AMINO-4...

CAS#:91012-53-2

Literature: Major,R.T.; Ohly,K.W. J. Med. Pharm. Chem., 1961 , vol. 4, # 2 p. 317 - 326

 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

N-methoxy-2-phenoxy-N-methyl-acetamide
n,o-dimethyl-2-phenoxy-acetohydroxamicaci
N-methoxy-N-methyl-2-phenoxyacetamide
n,o-dimethyl-2-phenoxyacetohydroxamicacid
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Chemsrc provides CAS#:91012-53-2 MSDS, density, melting point, boiling point, structure, etc. Its name is METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE>> amp version: METHYL3-AMINO-4-CYANOTHIOPHENE-2-CARBOXYLATE

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