1,3-PHENYLENE BIS(4-(1,1-DIMETHYLETHYL)BENZOATE)

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H30O4
Molecular Weight	430.5354
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3-PHENYLENE BIS(4-(1,1-DIMETHYLETHYL)BENZOATE)

Structure Search

SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC(OC(=O)C3=CC=C(C=C3)C(C)(C)C)=CC=C2

InChI

InChIKey=AFAZGSWKIZVRSR-UHFFFAOYSA-N

InChI=1S/C28H30O4/c1-27(2,3)21-14-10-19(11-15-21)25(29)31-23-8-7-9-24(18-23)32-26(30)20-12-16-22(17-13-20)28(4,5)6/h7-18H,1-6H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

1,3-PHENYLENE BIS(4-(1,1-DIMETHYLETHYL)BENZOATE)

Systematic Name

English

BENZOIC ACID, 4-(1,1-DIMETHYLETHYL)-, 1,1'-(1,3-PHENYLENE) ESTER

Common Name

English

BENZOIC ACID, 4-(1,1-DIMETHYLETHYL)-, 1,3-PHENYLENE ESTER

Common Name

English

Code System Code Type Description

PUBCHEM

87325

Created by admin on Sat Dec 16 12:18:47 GMT 2023 , Edited by admin on Sat Dec 16 12:18:47 GMT 2023

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FDA UNII

UP79TVJ4CM

Created by admin on Sat Dec 16 12:18:47 GMT 2023 , Edited by admin on Sat Dec 16 12:18:47 GMT 2023

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ECHA (EC/EINECS)

241-788-8

Created by admin on Sat Dec 16 12:18:47 GMT 2023 , Edited by admin on Sat Dec 16 12:18:47 GMT 2023

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EPA CompTox

DTXSID20170456

Created by admin on Sat Dec 16 12:18:47 GMT 2023 , Edited by admin on Sat Dec 16 12:18:47 GMT 2023

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CAS

17831-67-3

Created by admin on Sat Dec 16 12:18:47 GMT 2023 , Edited by admin on Sat Dec 16 12:18:47 GMT 2023

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SUBSTANCE RECORD


					UP79TVJ4CM

1,3-PHENYLENE BIS(4-(1,1-DIMETHYLETHYL)BENZOATE)