Estra-1,3,5(10)-trien-17-one

Modify Date: 2025-10-19 18:45:28

Estra-1,3,5(10)-trien-17-one structure	Common Name	Estra-1,3,5(10)-trien-17-one
	CAS Number	53-45-2	Molecular Weight	254.36700
	Density	1.088g/cm3	Boiling Point	387ºC at 760mmHg
	Molecular Formula	C₁₈H₂₂O	Melting Point	142-144 °C(Experimental)
	MSDS	N/A	Flash Point	167.8ºC

Name	(8R,9S,13S,14S)-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Synonym	More Synonyms

Density	1.088g/cm3
Boiling Point	387ºC at 760mmHg
Melting Point	142-144 °C(Experimental)
Molecular Formula	C₁₈H₂₂O
Molecular Weight	254.36700
Flash Point	167.8ºC
Exact Mass	254.16700
PSA	17.07000
LogP	4.11180
Index of Refraction	1.565
InChIKey	LGHBWDKMGOIZKH-CBZIJGRNSA-N
SMILES	CC12CCC3c4ccccc4CCC3C1CCC2=O
Storage condition	2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KG7744000

CHEMICAL NAME :: Estra-1,3,5(10)-trien-17-one

CAS REGISTRY NUMBER :: 53-45-2

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H22-O

MOLECULAR WEIGHT :: 254.40

WISWESSER LINE NOTATION :: L E5 B666 FVTTT&J E1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Subcutaneous

DOSE :: 4 mg/kg

SEX/DURATION :: male 1 day(s) pre-mating

TOXIC EFFECTS :: Reproductive - Paternal Effects - testes, epididymis, sperm duct Reproductive - Paternal Effects - prostate, seminal vesicle, Cowper's gland, accessory glands

REFERENCE :: ACENA7 Acta Endocrinologica (Copenhagen). (Periodica, Skolegade 12 E, DK-2500 Valby, Denmark) V.1- 1948- Volume(issue)/page/year: 49,193,1965

Name: Inhibition of recombinant human CYP1B1 expressed in bacterial microsomes co-expressin...
Source: ChEMBL
Target: Cytochrome P450 1B1
External Id: CHEMBL3877873

Name: Compound was tested for inhibition of porcine endometrial estrogen sulfotransferase
Source: ChEMBL
Target: Sulfotransferase
External Id: CHEMBL681340

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Agrestin

Desoxyestrone

estra-1,3,5(10)-trien-17-one

1,3,5(10)-estratrien-17-one

d-Estra-1,3,5(10)-trien-17-one

Deoxyestrone

3-Deoxyestrone

1,3,5(10)-Estratrien-17-one

3-Deoxyoestrone

Estratrien-17-one

Estrone,3-deoxy

3-Desoxyestrone

Adopron

Oestra-1,3,5(10)-trien-17-one

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Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Estra-1,3,5(10)-trien-17-one
Price: Check
Purity: 95.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Estra-1,3,5(10)-trien-17-one
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Estra-1,3,5(10)-trien-17-oneBioassay

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.