Chromonar Hydrochloride
Basic information
- CAS
655-35-6- Standard SMILES
CCOC(=O)COc1ccc2c(C)c(CCN(CC)CC)c(=O)oc2c1.Cl- InChIKey
KSQIAZKOUOEHSA-UHFFFAOYSA-N- Molecular formula
- C20H28ClNO5
- Average molar mass
- 397.9 g/mol
- Monoisotopic mass
- 397.1656007
Overview
Carbocromen hydrochloride is a member of coumarins.
Names & identifiers
- Preferred name
- Chromonar Hydrochloride
- IUPAC
- ethyl 2-[3-[2-(diethylamino)ethyl]-4-methyl-2-oxochromen-7-yl]oxyacetate;hydrochloride
- English name
- Carbocromene hydrochloride
- Molecular formula
- C20H28ClNO5
- Molecular weight
- 397.89302
Names & synonyms
Chromonar hydrochloride655-35-6Carbocromen hydrochlorideChromonar HClNSC-110430A-27053DTXSID204874952C937V399Acetic acid, ((3-(2-(diethylamino)ethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)-, ethyl ester, hydrochlorideDTXCID9028675Hydrochloride, ChromonarRefChem:577043
Show more names
CarbocAids126445Aids-126445intercordincarbocromeneintensain hydrochlorideCarbochroMen Hydrochloride
211-511-5Acetic acid, 2-((3-(2-(diethylamino)ethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)-, ethyl ester, hydrochloride (1:1)KarbochromenAntiangorIntenkordinIntensainKarbokromenCarbochromene hydrochloride
Database identifiers
- CAS
655-35-6- PubChem CID
- 9800972
- DTXSID
DTXSID2048749- ChEMBL
Properties
Computed structural properties
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 526
Physicochemical properties
- Melting point
- 159 · 159-160°
- solubility
- Chloroform (Slightly), Methanol (Slightly), Water (Slightly)
- form
- Solid
- color
- White to Off-White
- FDA UNII
- 52 C937V399 · 52C937V399
- Toxicity
- 50 in · LD50 in mice (g/kg): 6.3 orally; 0.528 i.p.; 0.0355 i.v. (Nitz, Potzch)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Toxicity
- LD50 in mice (g/kg): 6.3 orally; 0.528 i.p.; 0.0355 i.v. (Nitz, Potzch)
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationDrugs used to cause dilation of the blood vessels.
Applications
UsesVasodilator (coronary).
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Carbocromen hydrochloride is a member of coumarins.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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