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Home> Hot Product Listed T   > T6781211
3197-06-6 structure

T6781211

Iupac Name:2-[2-aminoethyl(2-hydroxyethyl)amino]ethanol
CAS No.:3197-06-6
Molecular Weight:148.206
Molecular Formula:C13H12F3N5O2S (isomer)
Names and Identifiers
Synonyms

3-cyclohexyl-1-[4-(2-hydroxypyridine-3-carbonyl)piperazin-1-yl]propan-1-one MCULE-8607437642 MOLPORT-009-093-013 Z758333270 ZINC58201476

Inchi
InChI=1S/C6H16N2O2/c7-1-2-8(3-5-9)4-6-10/h9-10H,1-7H2
InChkey
CYOIAXUAIXVWMU-UHFFFAOYSA-N
Canonical Smiles
C(CN(CCO)CCO)N
Properties
Melting Point
92 °C
Refractive Index
1.498
Safety and Handling
Risk Statements
R34
Safety Statements
S26;S27;S36/37/39;S45
PackingGroup
III
Transport
UN 2735
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 3197-06-6 EC: T6781211 ·ECHA C&L Inventory for CAS: CAS: 3197-06-6 EC: T6781211
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin corrosion, Category 1B

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H314 Causes severe skin burns and eye damage

Precautionary statement(s)
Prevention

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

Response

P301+P330+P331 IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P303+P361+P353 IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water [or shower].

P363 Wash contaminated clothing before reuse.

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

P310 Immediately call a POISON CENTER/doctor/\u2026

P321 Specific treatment (see ... on this label).

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:148.206g/mol
  • Molecular Formula:C13H12F3N5O2S
  • Compound Is Canonicalized:True
  • XLogP3-AA:_1.3
  • Exact Mass:148.121
  • Monoisotopic Mass:148.121
  • Complexity:64.8
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:69.7A^2
  • Heavy Atom Count:10
  • 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
  • CACTVS Substructure Key Fingerprint: AAADceBjMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAAAADhgAYAAANAAgAA AAAAAAAAAAAAAAAAAIAIAAACUAAAAAAQAAAAEACQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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Recommended Suppliers
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  • Fax:86-27-87772287
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  • Tel:0086-731-85415356
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  • Tel:+86-(25)-8645 8768
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