Pimelic acid
Suppliers
Names
[ CAS No. ]:
111-16-0
[ Name ]:
Pimelic acid
[Synonym ]:
Pimefilina [INN-Spanish]
Heptanedioic acid
1,3-dimethyl-7-[2-(pyridin-3-ylmethyl-amino)-ethyl]-3,7-dihydro-purine-2,6-dione
Pimefylline [INN]
Pimelic acid
Pimefyllinum [INN-Latin]
Pimefyllin
7-(ss-3'-Picolylaminoaethyl)-theophyllin
Pimephylline
7-(2-((3-Pyridylmethyl)amino)ethyl)theophylline
heptanedioate
1,7-heptanedioic acid
EINECS 203-840-8
Pimefylline
heptane-1,7-dioic acid
MFCD00004425
UNII-BZQ96WX25F
Chemical & Physical Properties
[ Density]:
1.2±0.1 g/cm3
[ Boiling Point ]:
353.7±25.0 °C at 760 mmHg
[ Melting Point ]:
103-105 °C(lit.)
[ Molecular Formula ]:
C7H12O4
[ Molecular Weight ]:
160.168
[ Flash Point ]:
181.9±19.7 °C
[ Exact Mass ]:
160.073563
[ PSA ]:
74.60000
[ LogP ]:
0.27
[ Vapour Pressure ]:
0.0±1.7 mmHg at 25°C
[ Index of Refraction ]:
1.476
[ Stability ]:
Stable. Incompatible with oxidizing agents, bases. Combustible.
[ Water Solubility ]:
25 g/L (13 ºC)
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- TK3677000
- CHEMICAL NAME :
- Pimelic acid
- CAS REGISTRY NUMBER :
- 111-16-0
- BEILSTEIN REFERENCE NO. :
- 1210024
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C7-H12-O4
- MOLECULAR WEIGHT :
- 160.19
- WISWESSER LINE NOTATION :
- QV5VQ
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 :
- 7 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 34ZIAG "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969 Volume(issue)/page/year: -,477,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 4800 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
- REFERENCE :
- BIJOAK Biochemical Journal. (Biochemical Soc. Book Depot, POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK) V.1- 1906- Volume(issue)/page/year: 34,1196,1940
Safety Information
[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves
[ Hazard Codes ]:
Xi:Irritant;
[ Risk Phrases ]:
R36/37/38
[ Safety Phrases ]:
S26-S36
[ RIDADR ]:
NONH for all modes of transport
[ WGK Germany ]:
2
[ RTECS ]:
TK3677000
[ HS Code ]:
2917190090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2917190090
[ Summary ]:
2917190090 acyclic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Articles
Clin. Chem. 40(6) , 862-6, (1994)
Organic acid concentrations were quantified by gas chromatography and the individual acids identified by mass spectrometry in urine specimens from a healthy Turkish pediatric population of ages 2 days...
Am. J. Clin. Nutr. 71(4) , 978-86, (2000)
Riboflavin, flavin mononucleotide (FMN), and flavin adenine dinucleotide (FAD) concentrations have been little studied in cases of malnutrition.Our objective was to investigate the effects of malnutri...
Acta Derm. Venereol. Suppl. (Stockh.) 143 , 8-13, (1989)
Medium chain length dicarboxylic acids (DA) from C8 to C13 are competitive inhibitors of tyrosinase in vitro. The introduction of electron acceptor groups or electron donor groups into the 2 and/or th...