1-Chloroestradiol

CAS

95846-28-9

Catalog Number

ACM95846289

Category

Other Products

MSDS COA Spec Sheet

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What is the PubChem CID for 1-Chloroestradiol?

The PubChem CID for 1-Chloroestradiol is 67379.

What is the molecular formula of 1-Chloroestradiol?

The molecular formula of 1-Chloroestradiol is C18H23ClO2.

What are the synonyms for 1-Chloroestradiol?

The synonyms for 1-Chloroestradiol are 95846-28-9, (8S,9S,13S,14S,17S)-1-chloro-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol, DTXSID60914790, 1-Chloroestra-1(10),2,4-triene-3,17-diol.

What is the molecular weight of 1-Chloroestradiol?

The molecular weight of 1-Chloroestradiol is 306.8 g/mol.

When was 1-Chloroestradiol created?

1-Chloroestradiol was created on August 8, 2005.

When was 1-Chloroestradiol last modified?

1-Chloroestradiol was last modified on December 30, 2023.

What is the IUPAC name of 1-Chloroestradiol?

The IUPAC name of 1-Chloroestradiol is (8S,9S,13S,14S,17S)-1-chloro-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol.

What is the InChI of 1-Chloroestradiol?

The InChI of 1-Chloroestradiol is InChI=1S/C18H23ClO2/c1-18-7-6-13-12(14(18)4-5-16(18)21)3-2-10-8-11(20)9-15(19)17(10)13/h8-9,12-14,16,20-21H,2-7H2,1H3/t12-,13+,14+,16+,18+/m1/s1.

What is the InChIKey of 1-Chloroestradiol?

The InChIKey of 1-Chloroestradiol is CKBZCMHPOSSDAN-PEEYHIECSA-N.

What is the canonical SMILES of 1-Chloroestradiol?

The canonical SMILES of 1-Chloroestradiol is CC12CCC3C(C1CCC2O)CCC4=C3C(=CC(=C4)O)Cl.

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