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111-16-0

111-16-0 structure
111-16-0 structure
  • Name: Pimelic acid
  • Chemical Name: pimelic acid
  • CAS Number: 111-16-0
  • Molecular Formula: C7H12O4
  • Molecular Weight: 160.168
  • Catalog: Chemical reagent Organic reagent fatty acid
  • Create Date: 2018-03-11 08:00:00
  • Modify Date: 2025-08-20 22:36:03
  • Pimelic acid is the organic compound and its derivatives are involved in the biosynthesis of the amino acid called lysine.
Name pimelic acid
Synonyms 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
Description Pimelic acid is the organic compound and its derivatives are involved in the biosynthesis of the amino acid called lysine.
Related Catalog
Target

Human Endogenous Metabolite

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)

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
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
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%
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