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Substance Name: Nicametate [INN:BAN:DCF]
RN: 3099-52-3
UNII: ML4O3WYO2M
InChIKey: JVWOCHRRAWHKLT-UHFFFAOYSA-N

Classification Codes

  • Cardiovascular Agents
  • Drug / Therapeutic Agent
  • Vasodilator Agents

Molecular Formula

  • C12-H18-N2-O2

Molecular Weight

  • 222.286
 
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Names and Synonyms

Name of Substance

  • Nicametate [INN:BAN:DCF]

Synonyms

  • 2-(Diethylamino)ethyl nicotinate
  • 4-22-00-00380 (Beilstein Handbook Reference)
  • BRN 0164971
  • EINECS 221-452-7
  • Nicametate
  • Nicametato
  • Nicametato [DCIT]
  • Nicametatum
  • Nicametatum [INN-Latin]
  • UNII-ML4O3WYO2M

Systematic Names

  • 2-(Diethylamino)ethyl nicotinate
  • Nicametate
  • Nicotinic acid, 2-(diethylamino)ethyl ester

Registry Numbers

CAS Registry Number

  • 3099-52-3

FDA UNII

  • ML4O3WYO2M

System Generated Number

  • 0003099523

Structure Descriptors

InChI

1S/C12H18N2O2/c1-3-14(4-2)8-9-16-12(15)11-6-5-7-13-10-11/h5-7,10H,3-4,8-9H2,1-2H3

InChIKey

JVWOCHRRAWHKLT-UHFFFAOYSA-N

Smiles

c1(cccnc1)C(OCCN(CC)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 250mg/kg (250mg/kg)   Pharmazie. Vol. 11, Pg. 242, 1956.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point < 25 deg C   EXP
log P (octanol-water) 1.320 (none)   EST
Atmospheric OH Rate Constant 9.63E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.