Bexarotene Impurity 13

Basic Information

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CAS Number

142-30-3

Molecular Formula

C8H14O2

Molecular Weight

74.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Melting Point

93.0 to 96.0 deg-C

Boiling Point

121-123 °C/7 mmHg

Water Solubility

240 g/L (20 ºC)

Flash Point

102℃

Solubility

240g/l

Refractive Index

1.4179 (estimate)

SMILES

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CC(C)(C#CC(C)(C)O)O

InChI

InChI=1S/C8H14O2/c1-7(2,9)5-6-8(3,4)10/h9-10H,1-4H3

InChIKey

IHJUECRFYCQBMW-UHFFFAOYSA-N

LogP

0.7771999999999999

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

160

Safety Information

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GHS Hazard Pictograms

H317

H334

Hazard Statement

H317 May cause an allergic skin reaction
Sensitization, Skin

H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled
Sensitization, respiratory

Synonyms & References

English

2, 5-Dimethyl-3-hexyne-2,5-diol
NCGC00258574-01
W-108176
NSC117261
NS00004482
A807887
EINECS 205-533-4
D 43 (VAN)
2,5-Dimethyl-3-hexyn-2,5-diol
2,5-Dimethyl-3-hexyne-2,5-diol, dl + meso
2,5-Dimethylhexyne-2,5-diol
Q27253671
MFCD00004468
Tetramethyl-2-butynediol
Olfine Y
J-660009
SY015723
3-Hexyne-2,5-diol, 2,5-dimethyl-
142-30-3
Dimethylhexynediol
22RR53U71W
AC1498
3-Hexyne-2, 2,5-dimethyl-
NSC 117261
D0738
2,5-dimethyl-hex-3-yne-2,5-diol
SCHEMBL190199
AKOS004904976
Kemitracin-50
NSC-117261
2,5-DIMETHYL-3-HEXYNE-2,5-DIOL [HSDB]

MDL Number

MFCD00004468

Customs Code

29053980

FAQ

What is Bexarotene Impurity 13 (CAS: 142-30-3)?

Bexarotene Impurity 13 (CAS: 142-30-3) is a synthetic compound identified as an impurity in the pharmaceutical drug bexarotene. It has the chemical formula C24H28O2 and is characterized by its solid-state properties, solubility in organic solvents, and potential role in drug purity analysis. This compound is primarily used for research and quality control purposes in pharmaceutical development.

What are the main uses of Bexarotene Impurity 13 (CAS: 142-30-3)?

Bexarotene Impurity 13 (CAS: 142-30-3) is mainly utilized in pharmaceutical research to study impurity profiles and ensure drug purity. It also plays a role in analytical chemistry for method validation and in the development of quality control standards for bexarotene-based medications. Its applications are limited to laboratory settings due to its status as a non-therapeutic byproduct.

Is Bexarotene Impurity 13 (CAS: 142-30-3) safe?

Bexarotene Impurity 13 (CAS: 142-30-3) is not intended for human or animal use and should be handled with care. Safety data indicates potential irritant properties, necessitating protective measures such as gloves, goggles, and proper ventilation. Compliance with OSHA and EPA guidelines is recommended, and exposure should be minimized to ensure workplace safety.

How should Bexarotene Impurity 13 (CAS: 142-30-3) be stored?

Bexarotene Impurity 13 (CAS: 142-30-3) should be stored in a sealed, airtight container in a cool (2-8°C), dry, and dark environment to maintain stability. Protection from moisture and light is critical, and storage areas should be well-ventilated. Always follow manufacturer guidelines for long-term preservation and safety.