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1,5,9-cyclododecatriene

CAS 4904-61-4C12H18MW 162.27

1,5,9-cyclododecatriene (CAS 4904-61-4) — formula C12H18, molecular weight 162.27; category organic chemicals.

Product Overview

CAS Number4904-61-4
Molecular FormulaC12H18
Molecular Weight162.27
Melting Point-0.4 °F (USCG, 1999)
Boiling Point447.8 °F at 760 mmHg (USCG, 1999)
LogP4.5
CategoryOrganic Chemicals

Technical Profile

What this product is

1,5,9-cyclododecatriene is a carbon-based organic compound with CAS registry number 4904-61-4 and molecular formula C12H18 (molecular weight 162.27), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 4904-61-4

Its molecular formula C12H18 comprises 12 C, 18 H atoms.

Also known as: 1,5,9-cyclododecatriene · 1,5,9-环十二碳三烯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 1,5,9-cyclododecatriene?

The CAS registry number of 1,5,9-cyclododecatriene is 4904-61-4.

What is the molecular formula and molecular weight of 1,5,9-cyclododecatriene?

Molecular formula C12H18, molecular weight 162.27.

What other names is 1,5,9-cyclododecatriene known by?

It is also registered under: 1,5,9-cyclododecatriene, 1,5,9-环十二碳三烯.

Which category does 1,5,9-cyclododecatriene belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 1,5,9-cyclododecatriene (CAS 4904-61-4), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number4904-61-4
PubChem CID12668
Molecular formulaC12H18
IUPAC namecyclododeca-1,5,9-triene
UNII (FDA)6Q5S1IRJ4Q

Computed descriptors

Molecular Weight162.27
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass162.140850574
Monoisotopic Mass162.140850574
Topological Polar Surface Area0
Heavy Atom Count12

Physicochemical values on record

Boiling Point447.8 °F at 760 mmHg (USCG, 1999)
Boiling Point240 °C at 101.3 kPa
Melting Point-0.4 °F (USCG, 1999)
Melting Point-17 °C
Flash Point160 °F (USCG, 1999)
Flash Point71 °C
Flash Point88 °C closed cup
Density0.89 at 20 °C/20 °C
DensityDensity: 0.84 g/cu cm at 100 °C
Vapor Pressure0.08 [mmHg]

Documented uses on record

    Used to make other chemicals; [CAMEO] Used in construction materials, fillers, insulation, intermediates, styren-butadiene rubbers, and thermoplastic polymers; [European Chemicals Bureau]Cyclododecatriene is an important precursor in organic chemistry.

    Synonyms and trade names

    cyclododeca-1,5,9-triene; 1,5,9-CYCLODODECATRIENE; 4904-61-4; DTXSID8027581; 6Q5S1IRJ4Q; DTXCID5065308; NSC-72433; c-CDDT; RefChem:417080; 225-533-8; UNII-PG450K437C; MFCD00063609; NCIOpen2_000351; SCHEMBL80406; SCHEMBL1112352; SCHEMBL1540885

    GHS hazard classification

    Reported hazard statementsH304 (100%), H400 (96.5%), H410 (100%), H227

    H304 (100%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]

    H400 (96.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

    What the public record says

    1,5,9-cyclododecatriene · CAS 4904-61-4 · C12H18. UNII 6Q5S1IRJ4Q. Boiling Point: 447.8 °F at 760 mmHg (USCG, 1999); Boiling Point: 240 °C at 101.3 kPa; Melting Point: -0.4 °F (USCG, 1999).

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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Supplier: Jinan Shenghe Chemical Co., Ltd.

中文页面: 1,5,9-环十二碳三烯

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