5,5'-METHYLENEDI-2,3-CRESOTIC ACID

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H16O6
Molecular Weight	316.3053
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5,5'-METHYLENEDI-2,3-CRESOTIC ACID

Structure Search

SMILES

CC1=CC(CC2=CC(C)=C(O)C(=C2)C(O)=O)=CC(C(O)=O)=C1O

InChI

InChIKey=UPLNCYRSCVJILM-UHFFFAOYSA-N

InChI=1S/C17H16O6/c1-8-3-10(6-12(14(8)18)16(20)21)5-11-4-9(2)15(19)13(7-11)17(22)23/h3-4,6-7,18-19H,5H2,1-2H3,(H,20,21)(H,22,23)

HIDE SMILES / InChI

Molecular Formula	C17H16O6
Molecular Weight	316.3053
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:45:03 GMT 2023` Edited by `admin` on `Sat Dec 16 12:45:03 GMT 2023`
Record UNII	S3D8KC88KC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5,5'-METHYLENEDI-2,3-CRESOTIC ACID

Common Name

English

3,3'-METHYLENEBIS(6-HYDROXY-5-METHYLBENZOIC ACID)

Systematic Name

English

NSC-408488

Code

English

BENZOIC ACID, 3,3'-METHYLENEBIS(6-HYDROXY-5-METHYL-

Systematic Name

English

NSC-623548

Code

English

2,2'-DIHYDROXY-3,3'-DIMETHYL-5,5'-METHYLENEDIBENZOIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

S3D8KC88KC

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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PUBCHEM

17413

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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EPA CompTox

DTXSID90180466

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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NSC

408488

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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NSC

623548

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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CAS

2581-36-4

Created by admin on Sat Dec 16 12:45:03 GMT 2023 , Edited by admin on Sat Dec 16 12:45:03 GMT 2023

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