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Home> Encyclopedia >   /  Others  /  Pharmaceutical Intermediates  /  Organic Intermediate  /  Pharmaceutical  /  Surfactants
STL160320 structure
STL160320 structure

STL160320

CAS No.:25322-68-3
Molecular Weight:62.06784
1. Names and Identifiers
1.1 Name
STL160320
1.2 Synonyms

3-(2-hydroxyethyl)-6,7-dimethoxy-1-[2-(piperidin-1-yl)ethyl]quinazoline-2,4(1h,3h)-dione 3-(2-hydroxyethyl)-6,7-dimethoxy-1-[2-(piperidin-1-yl)ethyl]quinazoline-2,4-dione AKOS005759728 BG00719804 MCULE-6892805144 MOLPORT-019-826-603 ZINC71280066

1.3 CAS No.
25322-68-3
1.4 Molecular Formula
C14H15FN4OS2 (isomer)
1.5 Inchi
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
1.6 InChkey
LYCAIKOWRPUZTN-UHFFFAOYSA-N
1.7 Canonical Smiles
OCCO
1.8 Isomers Smiles
OCCO
2. Properties
3.1 Melting point
-65℃
3.1 Refractive index
1.458-1.461
3.1 Vapour pressure
<0.01 mm Hg ( 20 °C)
3. Safety and Handling
4.1 Symbol
GHS06, GHS08, GHS09
4.1 Signal Word
Danger
4.1 Risk Statements
R36/38
4.1 Safety Statements
S24/25
4.1 Packing Group
Z01
4.1 Hazard Declaration
H302-H311-H373-H411
4.1 RIDADR
200
4.1 Caution Statement
P273-P280-P301 + P312 + P330-P302 + P352 + P312-P391-P501
4.1 WGK Germany
3
4.1 RTECS
TQ4110000
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Specific target organ toxicity \u2013 single exposure, Category 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H335 May cause respiratory irritation

Precautionary statement(s)
Prevention

P261 Avoid breathing dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

Response

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P312 Call a POISON CENTER/doctor/\u2026if you feel unwell.

Storage

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

5. Computational chemical data
  • Molecular Weight:62.06784g/mol
  • Molecular Formula:C14H15FN4OS2
  • XLogP3-AA:_1.4
  • Exact Mass:62.036779
  • Monoisotopic Mass:62.036779
  • Complexity:6
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.5
  • Heavy Atom Count:4
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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