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InChI key
DSSYKIVIOFKYAU-XCBNKYQSSA-N
InChI
1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
SMILES string
[H][C@](CC1=O)(CC2)C(C)(C)[C@]12C
vapor density
5.2 (vs air)
vapor pressure
4 mmHg ( 70 °C)
assay
≥95% (GC)
optical activity
[α]20/D +0.15 to -0.15°, c = 10% in ethanol
quality
meets analytical specification of Ph. Eur., BP, racemic
expl. lim.
3.5 %
impurities
acidity or alcalinity, complies, related subst., complies (GC), residual solvents, complies, water, complies, ≤0.01% halogene compounds (as Cl), ≤0.05% non-volatile matter
bp
204 °C (lit.)
mp
172-180 °C, 175-177 °C (lit.)
solubility
carbon disulfide: freely soluble, hexane: freely soluble, liquid sulfur dioxide: soluble, phenol/1,2-dichlorobenzene: soluble
suitability
complies for appearance of solution, passes test for identity
application(s)
pharmaceutical (small molecule)
Quality Level
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General description
signalword
Danger
Hazard Classifications
Acute Tox. 4 Inhalation - Aquatic Chronic 2 - Eye Dam. 1 - Flam. Sol. 2 - Skin Irrit. 2 - STOT SE 2 Inhalation
Storage Class
4.1B - Flammable solid hazardous materials
wgk
WGK 1
flash_point_f
147.9 °F - closed cup
flash_point_c
64.4 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
Regulatory Listings
Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.
Substances Subject to be Indicated Names
ishl_indicated
Substances Subject to be Notified Names
ishl_notified
20506-4X2KG: + 20506-25KG: + 20506-2.5KG: + 20506-1KG:4548173925851 + 20506-6X500G: + 20506-BULK: + 20506-500G:4548173958491 + 20506-6X1KG: + 20506-6X2.5KG: + 20506-VAR: + 20506-BULK-RAW: + 20506-2KG:4548173958484
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