4-(3,4-DIHYDRO-2,2,4-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)PHENOL, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H20O2
Molecular Weight	268.3502
Optical Activity	( - )
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(3,4-DIHYDRO-2,2,4-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)PHENOL, (S)-

Structure Search

SMILES

CC1(C)C[C@@](C)(C2=CC=C(O)C=C2)C3=CC=CC=C3O1

InChI

InChIKey=KXYDGGNWZUHESZ-SFHVURJKSA-N

InChI=1S/C18H20O2/c1-17(2)12-18(3,13-8-10-14(19)11-9-13)15-6-4-5-7-16(15)20-17/h4-11,19H,12H2,1-3H3/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H20O2
Molecular Weight	268.3502
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:59:45 GMT 2023` Edited by `admin` on `Sat Dec 16 10:59:45 GMT 2023`
Record UNII	5K7ULQ8VDH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(3,4-DIHYDRO-2,2,4-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)PHENOL, (S)-

Systematic Name

English

(4S)-4-P-HYDROXYPHENYL-2,2,4-TRIMETHYLCHROMAN

Systematic Name

English

4-(3,4-DIHYDRO-2,2,4-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)PHENOL, (-)-

Systematic Name

English

PHENOL, 4-((4S)-3,4-DIHYDRO-2,2,4-TRIMETHYL-2H-1-BENZOPYRAN-4-YL)-

Systematic Name

English

DIANIN'S COMPOUND, (-)-

Common Name

English

DIANIN'S COMPOUND, (S)-

Common Name

English

Code System Code Type Description

PUBCHEM

827489

Created by admin on Sat Dec 16 10:59:45 GMT 2023 , Edited by admin on Sat Dec 16 10:59:45 GMT 2023

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CAS

56954-96-2

Created by admin on Sat Dec 16 10:59:45 GMT 2023 , Edited by admin on Sat Dec 16 10:59:45 GMT 2023

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FDA UNII

5K7ULQ8VDH

Created by admin on Sat Dec 16 10:59:45 GMT 2023 , Edited by admin on Sat Dec 16 10:59:45 GMT 2023

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Related Record Type Details


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4-(4'-HYDROXYPHENYL)-2,2,4-TRIMETHYLCHROMAN

RACEMATE -> ENANTIOMER

Amount: