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Norgestrel

CAS 6533-00-2C21H28O2MW 312.4

Norgestrel (CAS 6533-00-2) — formula C21H28O2, molecular weight 312.4; category organic chemicals.

Product Overview

CAS Number6533-00-2
Molecular FormulaC21H28O2
Molecular Weight312.4
Melting Point205-207 °C
LogP3.3
CategoryOrganic Chemicals

Technical Profile

What this product is

Norgestrel is a carbon-based organic compound with CAS registry number 6533-00-2 and molecular formula C21H28O2 (molecular weight 312.4), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 6533-00-2

Its molecular formula C21H28O2 comprises 21 C, 28 H, 2 O atoms.

Also known as: Norgestrel · 诺孕烯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Norgestrel?

The CAS registry number of Norgestrel is 6533-00-2.

What is the molecular formula and molecular weight of Norgestrel?

Molecular formula C21H28O2, molecular weight 312.4.

What other names is Norgestrel known by?

It is also registered under: Norgestrel, 诺孕烯.

Which category does Norgestrel belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Norgestrel (CAS 6533-00-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number6533-00-2
PubChem CID4542
Molecular formulaC21H28O2
IUPAC name13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
UNII (FDA)HMS5079J18

Computed descriptors

Molecular Weight312.4
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass312.208930132
Monoisotopic Mass312.208930132
Topological Polar Surface Area37.3
Heavy Atom Count23

Physicochemical values on record

Melting Point205-207 °C

Documented uses on record

    In a representative chemical synthesis, 6-methoxy-alpha-tetralone is reacted with vinylmagnesium bromide, and the resulting 1,2,3,4-tetrahydro-6-methoxy-1-vinyl-1-naphthol is condensed with 2-ethyl-1,3-cyclopentanedione to form initially a tricyclic intermediate (secosteroid) containing all of the gonane skeleton carbon atoms. Cyclization of the secosteroid via dehydration yields a 13-ethylgona-1,3,5(10)-8,14-pentaene structure which is then successively reduced and ethynylated.Prepn: H. Smith, Belg. pat. 623,844 (1963), C.A. 61, 4427c (1964); G.A. Hughes, H. Smith, U.S. pat. 3,959,322 (1976 to Herchel Smith)

    Synonyms and trade names

    norgestrel; Methylnorethindrone; Ld norgestrel; Norgestrelum; Monovar; Neogest; 6533-00-2; 17-ethynyl-17-hydroxy-18a-homoestr-4-en-3-one; Wy 3707; FH 122-A; SH 850; SH 70850; (-)-NORGESTREL 98; .alpha.-Norgestrel; (.+/-.)-Norgestrel; 13beta-Ethyl-17alpha-ethynyl-17beta-hydroxygon-4-en-3-one

    GHS hazard classification

    Reported hazard statementsH315 (11.1%), H319 (11.1%), H351 (92.6%), H360 (88.9%), H362 (88.9%), H400 (88.9%), H410 (88.9%)

    H315 (11.1%): Causes skin irritation [Warning Skin corrosion/irritation]

    H319 (11.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

    What the public record says

    Norgestrel · CAS 6533-00-2 · C21H28O2. UNII HMS5079J18. Melting Point: 205-207 °C.

    Physical description and handling notes

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

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