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Home> Hot Product Listed 1   > 1H-Benzocycloheptene,decahydro-2,5,9,9-tetramethyl-
32503-27-8 structure

1H-Benzocycloheptene,decahydro-2,5,9,9-tetramethyl-

CAS No.:32503-27-8
Molecular Weight:242.46374
Molecular Formula:C16H20O2 (isomer)
Names and Identifiers
Synonyms

a-Himachalene, tetrahydro- (6CI) Himachalane

Inchi
InChI=1/C16H36N.H2O4S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-5(2,3)4/h5-16H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
InChkey
OHLITOUHJLRUQJ-UHFFFAOYSA-N
Canonical Smiles
CCCC[N+](CCCC)(CCCC)CCCC
Properties
Melting Point
168-172℃
Boiling Point
468.6°Cat760mmHg
Flash Point
°C
HS Code
29239000
Safety and Handling
Risk Statements
R22;R36/37/38
Safety Statements
S26;S37/39
Transport
200kgs
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 0_10 view >
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Sustainability Support Services (Europe) AB 2017
Connect Chemicals Italia S.r.l. 2016
more >
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

H314 Causes severe skin burns and eye damage

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:242.46374g/mol
  • Molecular Formula:C16H20O2
  • Exact Mass:242.284775
  • Monoisotopic Mass:242.284775
  • Complexity:116
  • Rotatable Bond Count:12
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:17
  • 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
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