13-Azacyclotridecan-1-one

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Names

[ CAS No. ]:
947-04-6

[ Name ]:
13-Azacyclotridecan-1-one

[Synonym ]:
cyclododecanone isooxime
MFCD00005104
EINECS 213-424-8

Chemical & Physical Properties

[ Density]:
0.884g/cm3

[ Boiling Point ]:
314.9ºC at 760mmHg

[ Melting Point ]:
150-153ºC(lit.)

[ Molecular Formula ]:
C12H23NO

[ Molecular Weight ]:
197.31700

[ Flash Point ]:
188.2ºC

[ Exact Mass ]:
197.17800

[ PSA ]:
29.10000

[ LogP ]:
3.34600

[ Index of Refraction ]:
1.44

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CL6940000
CHEMICAL NAME :
Azacyclotridecan-2-one
CAS REGISTRY NUMBER :
947-04-6
BEILSTEIN REFERENCE NO. :
0122031
LAST UPDATED :
199710
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C12-H23-N-O

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - tremor
REFERENCE :
JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 60,1058,1971 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1681 No. of Facilities: 24 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 1534 (estimated) No. of Female Employees: 1168 (estimated)

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ RIDADR ]:
UN 3257

[ WGK Germany ]:
1

[ RTECS ]:
CL6940000

[ HS Code ]:
2933790090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Cyclododecanone
  • CYCLODODECANONE OXIME
  • 2-chloro-4,6-bis(cyclododecylidene-aminooxy)-1,3,5-triazine
  • azacyclotridecane-2,13-dione
  • Cyclododecane
  • cyclooctanone oxime
  • cyclododecanone O-trimethylsilyl oxime
  • 12-Aminododecanoic acid
  • N-Cyclohexylidenemethanamine

DownStream

  • oxacyclotridecan-2-one
  • 12-AMINO-1-DODECANOIC ACID, METHYL ESTER, HYDROCHLORIDE SALT
  • Cyclododecanone
  • Azacyclotridecane
  • 12-Aminododecanoic acid
  • Azacyclododecan-2-one
  • Dodecanoic acid, 12-hydroxy-, Methyl ester
  • 1-Azacyclotridecan-2-one, 1-methyl-

Customs

[ HS Code ]: 2933790090

[ Summary ]:
2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0%

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Related Compounds

  • 13-Oxadispiro[5.0.5.1]tridecan-1-one(6CI,8CI,9CI)
  • 13-ethyl-2,3,7,8,12,14-hexamethyl-15,16-dihydro-tripyrrin-1-one
  • 2-Cyclohexen-1-one,5-methyl-4-(1-methylethyl)-,trans-(9CI)
  • 2H-acridin-1-one
  • 2-iminonaphthalen-1-one
  • 2-methylcyclopentadecan-1-one
  • 5-(4-Bromophenyl)-3-(tert-butyl)-1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8(1H)-one
  • 1-[4-(4-Hydroxy-2-methoxyphenethyl)phenyl]-1-pentanone
  • tert-Butyl 4-hydroxy-4-[2-(methoxycarbonyl)-1-benzofuran-5-yl]-1-piperidinecarboxylate
  • [5-(4-Bromophenyl)-1-methyl-1H-pyrazol-4-yl](4,6-dichloro-5-pyrimidinyl)methanol
  • 2-Benzyloctahydro-4H-isoindol-4-one oxime
  • tert-Butyl 5,6-dihydroxyoctahydro-2H-isoindole-2-carboxylate
  • 8-(1-Butoxyvinyl)[1,5]naphthyridin-2-yl methyl ether
  • 1-[5-Fluoro-6-(3-methylbutanoyl)-2-(methylsulfonyl)-4-pyrimidinyl]-3-methyl-1-butanone
  • Phenyl 1-[3-fluoro-4-(trifluoromethyl)benzyl]-4-piperidinylcarbamate
  • 3-[5-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl]propanoic acid
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