3-chloroadamantanecarboxylic acid

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Names

[ CAS No. ]:
34859-74-0

[ Name ]:
3-chloroadamantanecarboxylic acid

[Synonym ]:
3-chloroadamantyl-1-carboxylic acid
Tricyclo[3.3.1.1]decane-1-carboxylic acid, 3-chloro-, (5R,7S)-
3-chloroadamantanecarboxylic acid
3-chloro-1-adamantanecarboxylic acid
3-Chlor-adamantan-carbonsaeure-(1)
1-Chloro-3-adamantanecarboxylic acid
3-ADAMANTANECARBOXYLIC ACID,1-CHLORO
(1r,3s,5R,7S)-3-Chloro-1-adamantanecarboxylic acid
MFCD00167831

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
343.2±15.0 °C at 760 mmHg

[ Melting Point ]:
136 °C

[ Molecular Formula ]:
C11H15ClO2

[ Molecular Weight ]:
214.689

[ Flash Point ]:
161.4±20.4 °C

[ Exact Mass ]:
214.076050

[ PSA ]:
37.30000

[ LogP ]:
2.36

[ Vapour Pressure ]:
0.0±1.6 mmHg at 25°C

[ Index of Refraction ]:
1.571

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AU4452700
CHEMICAL NAME :
3-Adamantanecarboxylic acid, 1-chloro-
CAS REGISTRY NUMBER :
34859-74-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H15-Cl-O2
MOLECULAR WEIGHT :
214.71
WISWESSER LINE NOTATION :
L 66 B6/B-H/DI A B- C 1B ITJ AVQ CG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1500 mg/kg
TOXIC EFFECTS :
Behavioral - anticonvulsant
REFERENCE :
RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 43,73,1980

Safety Information

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ HS Code ]:
2916209090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Adamantane-1-carboxylic acid
  • 3-nitrooxyadamantane-1-carboxylic acid
  • 1-acetamido-3-adamantanecarboxylic acid
  • 3-Bromo-1-adamantanecarboxylic acid
  • 3-hydroxyadamantane-1-carboxylic acid

DownStream

  • Adamantane
  • 1,3-Dehydroadamantane
  • 1-Chloroadamantane
  • 1-Bromoadamantane
  • Tricyclo[3.3.1.13,7]decane,1-iodo-

Customs

[ HS Code ]: 2916209090

[ Summary ]:
2916209090 other cyclanic, cyclenic or cyclotherpenic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

Related Compounds

  • 1-chloroadamantanecarboxylic acid chloride
  • 3-dodecanoyltetradecanoic acid
  • β-Chlorolactic acid
  • 3-methoxybutanoic acid
  • 3-THIOPHENEBUTANOIC ACID
  • 3-Pyridinecarboxylic acid, 6-(1-hydroxyethyl)- (9CI)