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Details

Stereochemistry ACHIRAL
Molecular Formula C18H22O2
Molecular Weight 270.3661
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METAHEXESTROL

SMILES

CC[C@H]([C@H](CC)C1=CC(O)=CC=C1)C2=CC=CC(O)=C2

InChI

InChIKey=KUJAWCSIKNKXLL-HDICACEKSA-N
InChI=1S/C18H22O2/c1-3-17(13-7-5-9-15(19)11-13)18(4-2)14-8-6-10-16(20)12-14/h5-12,17-20H,3-4H2,1-2H3/t17-,18+

HIDE SMILES / InChI

Molecular Formula C18H22O2
Molecular Weight 270.3661
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:59:21 GMT 2025
Edited
by admin
on Tue Apr 01 19:59:21 GMT 2025
Record UNII
DSF584X94B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METAHEXESTROL
Common Name English
NSC-297170
Preferred Name English
NSC-366211
Code English
PHENOL, 3,3'-((1R,2S)-1,2-DIETHYL-1,2-ETHANEDIYL)BIS-, REL-
Systematic Name English
Code System Code Type Description
FDA UNII
DSF584X94B
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY
PUBCHEM
6917687
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY
NSC
366211
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY
EPA CompTox
DTXSID901350637
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY
CAS
68266-24-0
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
CAS
71953-72-5
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY
NSC
297170
Created by admin on Tue Apr 01 19:59:21 GMT 2025 , Edited by admin on Tue Apr 01 19:59:21 GMT 2025
PRIMARY