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isocyclocitral

CAS 1335-66-6C10H16OMW 152.23

isocyclocitral (CAS 1335-66-6) — formula C10H16O, molecular weight 152.23; category organic chemicals.

Product Overview

CAS Number1335-66-6
Molecular FormulaC10H16O
Molecular Weight152.23
Melting Point-55.00 °C. @ 760.00 mm Hg
Boiling Point214.00 °C. @ 760.00 mm Hg
LogP2.870
CategoryOrganic Chemicals

Technical Profile

What this product is

isocyclocitral is a carbon-based organic compound with CAS registry number 1335-66-6 and molecular formula C10H16O (molecular weight 152.23), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 1335-66-6

Its molecular formula C10H16O comprises 10 C, 16 H, 1 O atoms.

Also known as: isocyclocitral · 异环柠檬醛

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of isocyclocitral?

The CAS registry number of isocyclocitral is 1335-66-6.

What is the molecular formula and molecular weight of isocyclocitral?

Molecular formula C10H16O, molecular weight 152.23.

What other names is isocyclocitral known by?

It is also registered under: isocyclocitral, 异环柠檬醛.

Which category does isocyclocitral belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for isocyclocitral (CAS 1335-66-6), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number1335-66-6
PubChem CID101150
Molecular formulaC10H16O
IUPAC name2,4,6-trimethylcyclohex-3-ene-1-carbaldehyde
UNII (FDA)3RP77Q40LC

Computed descriptors

Molecular Weight152.23
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass152.120115130
Monoisotopic Mass152.120115130
Topological Polar Surface Area17.1
Heavy Atom Count11

Physicochemical values on record

Boiling Point214.00 °C. @ 760.00 mm Hg
Melting Point-55.00 °C. @ 760.00 mm Hg
Solubility106 mg/L @ 20 °C (exp)
LogP2.870

Documented uses on record

  • 3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl-: ACTIVE

Synonyms and trade names

1423-46-7; Vertonal; 3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl-; 2,4,6-Trimethylcyclohex-3-enecarbaldehyde; 2,4,6-Trimethyl-3-cyclohexene-1-carboxaldehyde; 2,4,6-Trimethyl-3-cyclohexene-1-carbaldehyde; 2,4,6-Trimethyl-4-cyclohexene-1-carboxaldehyde; 3RP77Q40LC; EINECS 215-833-7; NSC 406736; NSC-406736; AI3-07328; DTXSID5052678; 3-Cyclohexene-1-carboxaldehyde, 2,4,6-trimethyl; 2,4,6-TRIMETHYL-3-CYCLOHEXENYLCARBALDEHYDE; 2,4,6-TRIMETHYL-3-CYCLOHEXENYLCARBOXALDEHYDE

GHS hazard classification

Reported hazard statementsH317, H315 (46%), H319 (82%), H334 (13.5%), H400 (13.5%), H412 (86.5%)

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

What the public record says

isocyclocitral · CAS 1335-66-6 · C10H16O. UNII 3RP77Q40LC. Boiling Point: 214.00 °C. @ 760.00 mm Hg; Melting Point: -55.00 °C. @ 760.00 mm Hg; Solubility: 106 mg/L @ 20 °C (exp).

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

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Supplier: Jinan Shenghe Chemical Co., Ltd.

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