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Home> Hot Product Listed F   > F5832-0056
646477-45-4 structure

F5832-0056

Iupac Name:8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
CAS No.:646477-45-4
Molecular Weight:213.146
Molecular Formula:C10H9N3O2 (isomer)
Names and Identifiers
Synonyms

3-chloro-2-methyl-n-((4-(thiophen-2-yl)tetrahydro-2h-pyran-4-yl)methyl)benzenesulfonamide AKOS024520900 MCULE-9382819286 MOLPORT-009-744-206 sr-01000925263 SR-01000925263-1 VU0522519-1 ZINC38593366

Inchi
InChI=1S/C8H16N2.2ClH/c1-10-7-2-3-8(10)5-6(9)4-7;;/h6-8H,2-5,9H2,1H3;2*1H
InChkey
KVYQKWPZQKGICY-UHFFFAOYSA-N
Canonical Smiles
CN1C2CCC1CC(C2)N.Cl.Cl
Properties
Melting Point
250 ºC
Safety and Handling
Risk Statements
R22;R36/37/38
Safety Statements
S22;S26;S36/37/39
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 646477-45-4 EC: F5832-0056 ·ECHA C&L Inventory for CAS: CAS: 646477-45-4 EC: F5832-0056
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Skin irritation, Category 2

Eye irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H302 Harmful if swallowed

H315 Causes skin irritation

H319 Causes serious eye irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

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

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/…if you feel unwell.

P330 Rinse mouth.

P302+P352 IF ON SKIN: Wash with plenty of water/...

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

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

P337+P313 If eye irritation persists: Get medical advice/attention.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:213.146g/mol
  • Molecular Formula:C10H9N3O2
  • Compound Is Canonicalized:True
  • Exact Mass:212.085
  • Monoisotopic Mass:212.085
  • Complexity:121
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:29.3A^2
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:2
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:3
  • CACTVS Substructure Key Fingerprint: AAADceBzAAAGAAAAAAAAAAAAAAAAAWAAAAAsAAAABgAAAAAAAAAAHAAQAAAACCjBAAQCAANAAAAA AAAAAAAAAAAAAAAAAIAIAAAAAAIAwAAEAAAAEACAAAEQgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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