Hydroxyprogesterone acetate

CAS

302-23-8

Catalog Number

ACM302238

Category

Steroidal Compounds

Molecular Weight

372.5

Molecular Formula

C₂₃H₃₂O₄

MSDS COA Spec Sheet

If you have any other questions or need other size, please get a quote.

Specification

Synonyms

Chlormadinone acetate impurity G; 4-Pregnen-17α-ol-3,20-dione acetate; 17a-Hydroxy-progesterone acetate; 17α-Acetoxyprogesterone; 17α-Acetoxy-4-pregnene-3,20-dione; ProgesteroneAcetate; 17ALPHA-ACETOXYPROGESTERONE; Hydroxyprogesterone acetate; 17α-Hydroxy-4-pregnene-3,20-dione 17-acetate;

IUPAC Name

[(8S,9S,10R,13S,14S,17S)-17-acetyl-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-1-yl]acetate

Canonical SMILES

CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CC(C34C)OC(=O)C)C

InChI Key

FSXXWLFRHSAFAC-PBCHSKRKSA-N

Boiling Point

490.2ºC at 760 mmHg

Melting Point

249-250ºC

Flash Point

211.6ºC

Density

1.14 g/cm³

Appearance

white powder

Exact Mass

372.23000

Hazard Statements

Xn: Harmful;

Safety Description

22-24/25-45

WGK Germany

What is the molecular formula of hydroxyprogesterone acetate?

The molecular formula of hydroxyprogesterone acetate is C23H32O4.

What is the molecular weight of hydroxyprogesterone acetate?

The molecular weight of hydroxyprogesterone acetate is 372.5 g/mol.

What is the IUPAC name of hydroxyprogesterone acetate?

The IUPAC name of hydroxyprogesterone acetate is [(8R,9S,10R,13S,14S,17R)-17-acetyl-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate.

What is the InChI of hydroxyprogesterone acetate?

The InChI of hydroxyprogesterone acetate is InChI=1S/C23H32O4/c1-14(24)23(27-15(2)25)12-9-20-18-6-5-16-13-17(26)7-10-21(16,3)19(18)8-11-22(20,23)4/h13,18-20H,5-12H2,1-4H3/t18-,19+,20+,21+,22+,23+/m1/s1.

What is the InChIKey of hydroxyprogesterone acetate?

The InChIKey of hydroxyprogesterone acetate is VTHUYJIXSMGYOQ-KOORYGTMSA-N.

What is the canonical SMILES of hydroxyprogesterone acetate?

The canonical SMILES of hydroxyprogesterone acetate is CC(=O)C1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)OC(=O)C.

How many hydrogen bond donor counts does hydroxyprogesterone acetate have?

Hydroxyprogesterone acetate has 0 hydrogen bond donor counts.

How many rotatable bond counts does hydroxyprogesterone acetate have?

Hydroxyprogesterone acetate has 3 rotatable bond counts.

What is the topological polar surface area of hydroxyprogesterone acetate?

The topological polar surface area of hydroxyprogesterone acetate is 60.4Å².

How many defined atom stereocenter counts does hydroxyprogesterone acetate have?

Hydroxyprogesterone acetate has 0 defined atom stereocenter counts.