Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 3   > 3-(AMinoMethyl)indoline Dihydrochloride
156454-43-2 structure

3-(AMinoMethyl)indoline Dihydrochloride

Iupac Name:5-bromo-7-methyl-1H-indazole
CAS No.:156454-43-2
Molecular Weight:211.05900
Molecular Formula:C22H21CLN6O2 (isomer)
Names and Identifiers
Synonyms

3-(aminomethyl)indoline 2hcl 5682AJ AK187380 AKOS024438544 SY022297 TC-307238 TRA-0183736 Z-4688

Inchi
InChI=1S/C8H7BrN2/c1-5-2-7(9)3-6-4-10-11-8(5)6/h2-4H,1H3,(H,10,11)
InChkey
OUNQFZFHLJLFAR-UHFFFAOYSA-N
Canonical Smiles
CC1=C2C(=CC(=C1)Br)C=NN2
Properties
Melting Point
184-185ºC
Vapour
0mmHg at 25°C
Refractive Index
1.697
HS Code
2933990090
Safety and Handling
Risk Statements
R22
HazardClass
IRRITANT
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H302 Harmful if swallowed

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

Response

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell.

P330 Rinse mouth.

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:211.05900g/mol
  • Molecular Formula:C22H21CLN6O2
  • Compound Is Canonicalized:True
  • Exact Mass:209.979
  • Monoisotopic Mass:209.979
  • Complexity:151
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:28.7A^2
  • Heavy Atom Count:11
  • 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: AAADcYBzAAAAEAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAFgB8AAAHABYAAABrAjBHgQ+wPBjAACi AzRnQACSBAAggAQQuSAgRLgIIKKA0dGApABgiAAIyhcQgEAOAAAiEAACAAAAAEQgAAQAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-21-61723543
  • Fax:86-21-33250189
  • Tel:86-512-63009836
  • Fax:86-512-63006936
  • Tel:86-571-85586718
  • Fax:86-571-85864795
  • Tel:86-25-66112885
  • Fax:86-25-66112885
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
  • Tel:86-21-61723543
  • Fax:86-21-33250189
  • Tel:86-512-63009836
  • Fax:86-512-63006936
  • Tel:86-571-85586718
  • Fax:86-571-85864795
  • Tel:86-25-66112885
  • Fax:86-25-66112885
 
<