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Voriconazole

CAS 137234-62-9C16H14F3N5OMW 349.31

Voriconazole (CAS 137234-62-9) — formula C16H14F3N5O, molecular weight 349.31; category organic chemicals.

Product Overview

CAS Number137234-62-9
Molecular FormulaC16H14F3N5O
Molecular Weight349.31
Melting Point134
LogP1.7
CategoryOrganic Chemicals

Technical Profile

What this product is

Voriconazole is a carbon-based organic compound with CAS registry number 137234-62-9 and molecular formula C16H14F3N5O (molecular weight 349.31), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 137234-62-9

Its molecular formula C16H14F3N5O comprises 16 C, 14 H, 3 F, 5 N, 1 O atoms.

Also known as: Voriconazole

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Voriconazole?

The CAS registry number of Voriconazole is 137234-62-9.

What is the molecular formula and molecular weight of Voriconazole?

Molecular formula C16H14F3N5O, molecular weight 349.31.

What other names is Voriconazole known by?

It is also registered under: Voriconazole.

Which category does Voriconazole belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Voriconazole (CAS 137234-62-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number137234-62-9
PubChem CID71616
Molecular formulaC16H14F3N5O
IUPAC name(2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol
UNII (FDA)JFU09I87TR

Computed descriptors

Molecular Weight349.31
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass349.11504457
Monoisotopic Mass349.11504457
Topological Polar Surface Area76.7
Heavy Atom Count25

Physicochemical values on record

Melting Point134
Melting Point127 - 130 °C
Solubility9.78e-02 g/L
LogP1.7

Documented uses on record

    Use (kg; approx.) in Germany (2009): >100Consumption (g per capita; approx.) in Germany (2009): 0.00122

    Synonyms and trade names

    Voriconazole; 137234-62-9; Vfend; (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol; UK-109496; Voriconazol; (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol; Voriconazolum; UK-109,496; UK 109496; JFU09I87TR; NSC-759888; DTXSID5046485; CHEBI:10023; DTXCID3026485; UK109496

    GHS hazard classification

    Reported hazard statementsH301 (99.2%), H351 (93.2%), H360 (32.2%), H361 (66.9%), H373 (97.5%), H400 (23.7%), H410 (23.7%), H412 (96.6%)

    H301 (99.2%): Toxic if swallowed [Danger Acute toxicity, oral]

    H351 (93.2%): Suspected of causing cancer [Warning Carcinogenicity]

    What the public record says

    Voriconazole · CAS 137234-62-9 · C16H14F3N5O. UNII JFU09I87TR. Melting Point: 134; Melting Point: 127 - 130 °C; Solubility: 9.78e-02 g/L.

    Physical description and handling notes

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

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