3,6-DIMETHYLOCT-6-EN-4-YN-3-OL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C10H16O
Molecular Weight	152.2334
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 3,6-DIMETHYLOCT-6-EN-4-YN-3-OL

Structure Search

SMILES

CCC(C)(O)C#C\C(C)=C\C

InChI

InChIKey=XYRKRLCDCBKVGW-WEVVVXLNSA-N

InChI=1S/C10H16O/c1-5-9(3)7-8-10(4,11)6-2/h5,11H,6H2,1-4H3/b9-5+

HIDE SMILES / InChI

Molecular Formula	C10H16O
Molecular Weight	152.2334
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:05:47 GMT 2023` Edited by `admin` on `Sat Dec 16 19:05:47 GMT 2023`
Record UNII	TNL9Z58JTY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,6-DIMETHYLOCT-6-EN-4-YN-3-OL

Systematic Name

English

6-Octen-4-yn-3-ol, 3,6-dimethyl-

Systematic Name

English

6-Octen-4-yn-3-ol, 3,6-dimethyl-, (E)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

5371348

Created by admin on Sat Dec 16 19:05:47 GMT 2023 , Edited by admin on Sat Dec 16 19:05:47 GMT 2023

PRIMARY

EPA CompTox

DTXSID50886513

Created by admin on Sat Dec 16 19:05:47 GMT 2023 , Edited by admin on Sat Dec 16 19:05:47 GMT 2023

PRIMARY

CAS

40454-30-6

Created by admin on Sat Dec 16 19:05:47 GMT 2023 , Edited by admin on Sat Dec 16 19:05:47 GMT 2023

PRIMARY

CAS

62851-70-1

Created by admin on Sat Dec 16 19:05:47 GMT 2023 , Edited by admin on Sat Dec 16 19:05:47 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

TNL9Z58JTY

Created by admin on Sat Dec 16 19:05:47 GMT 2023 , Edited by admin on Sat Dec 16 19:05:47 GMT 2023

PRIMARY