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Home> Hot Product Listed 2   > (2,3-DIMETHOXY-BENZYL)-(2-METHOXY-1-METHYL-ETHYL)-AMINE
1193-81-3 structure

(2,3-DIMETHOXY-BENZYL)-(2-METHOXY-1-METHYL-ETHYL)-AMINE

Iupac Name:1-cyclohexylethanol
CAS No.:1193-81-3
Molecular Weight:128.21200
Molecular Formula:C22H29P (isomer)
Names and Identifiers
Synonyms

(2,3-dimethoxybenzyl)(2-methoxy-1-methylethyl)amine [(2,3-dimethoxyphenyl)methyl](1-methoxypropan-2-yl)amine acm356090874 AK-92261 AKOS000230748 AKOS017273254 BAS 01124601 CHEMBL1621047 CHEMBRDG-BB 5522707 DB-016271 DTXSID80385968 MOLPORT-001-504-864 n-(2,3-dimethoxybenzyl)-1-methoxypropan-2-amine n-[(2,3-dimethoxyphenyl)methyl]-1-methoxypropan-2-amine OPREA1_007461 OPREA1_500170 OR164171 sel10052126 ST50007262 STK145484 UKRORGSYN-BB BBV-124065 W-8328 zx-cm011279

Inchi
InChI=1S/C8H16O/c1-7(9)8-5-3-2-4-6-8/h7-9H,2-6H2,1H3
InChkey
JMSUNAQVHOHLMX-UHFFFAOYSA-N
Canonical Smiles
CC(C1CCCCC1)O
Properties
Density
1.073
Boiling Point
342°C at 760 mmHg
Vapour
0.16mmHg at 25°C
Refractive Index
n20/D 1.465(lit.)
Flash Point
335.4°C
HS Code
29061900
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S23-S24/25
PackingGroup
III
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  
INTERMEDIATE INDIVIDUAL INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Symrise AG 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Dermal, Category 4

Skin irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H312 Harmful in contact with skin

H315 Causes skin irritation

Precautionary statement(s)
Prevention

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

P264 Wash ... thoroughly after handling.

Response

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

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

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

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

P332+P313 If skin irritation occurs: 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:128.21200g/mol
  • Molecular Formula:C22H29P
  • Compound Is Canonicalized:True
  • Exact Mass:128.12
  • Monoisotopic Mass:128.12
  • Complexity:74.6
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:20.2A^2
  • Heavy Atom Count:9
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBwIAAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAAAAAAAGgAACAAADRSggAICAAAAAgAA AAAAAAAAAAAAAAAAAAAAAAAAEAIAAAAAQAAEAAAAAAGAwKAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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