Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed P   > Phenol, 2-chloro-3-(hydrazinomethyl)- (9CI)
112-44-7 structure

Phenol, 2-chloro-3-(hydrazinomethyl)- (9CI)

Iupac Name:undecanal
CAS No.:112-44-7
Molecular Weight:170.296
Molecular Formula:C21H27N3O5S2 (isomer)
Names and Identifiers
Synonyms

2-chloro-3-(hydrazinomethyl)phenol 2-chloro-3-(hydrazinylmethyl)phenol AK457450 AKOS027412620 KB-283746 phenol, 2-chloro-3-(hydrazinomethyl)- (9ci) ZINC39128157

Inchi
InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3
InChkey
KMPQYAYAQWNLME-UHFFFAOYSA-N
Canonical Smiles
CCCCCCCCCCC=O
Properties
Density
1.373
Melting Point
-2℃
Boiling Point
618.668°C at 760 mmHg
Vapour
0.0832mmHg at 25°C
Refractive Index
1.4322
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S26
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 100_1000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
FIRMENICH UK Ltd. 2016
Givaudan UK OR1 2017
Kao Chemicals Europe, S.L. (2) 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Skin irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H315 Causes skin irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

Response

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.

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:170.296g/mol
  • Molecular Formula:C21H27N3O5S2
  • Compound Is Canonicalized:True
  • Exact Mass:170.167
  • Monoisotopic Mass:170.167
  • Complexity:89
  • Rotatable Bond Count:9
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:17.1A^2
  • Heavy Atom Count:12
  • 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: AAADceBwIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAAAAAACACggAICAAAAAAAI AAgQgAAAAAAAAAAAAAEAAAAAABIAAAAAAAAAAAAAAAEIiICAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:+1-(973)-740-2300
  • Fax:+1-(973)-740-1839
  • Tel:+91-(80)-23481626
  • Fax:+91-(80)-23281764
 
<