DIBUTYL TEREPHTHALATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H22O4
Molecular Weight	278.3435
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIBUTYL TEREPHTHALATE

Structure Search

SMILES

CCCCOC(=O)C1=CC=C(C=C1)C(=O)OCCCC

InChI

InChIKey=LQLQDKBJAIILIQ-UHFFFAOYSA-N

InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-7-9-14(10-8-13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C16H22O4
Molecular Weight	278.3435
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
[Studies on the chemical constituents from aerial parts of Gynura divaricata].	2010 Mar	20681301

Patents

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:12:27 GMT 2023` Edited by `admin` on `Sat Dec 16 08:12:27 GMT 2023`
Record UNII	7O6SH6VN97
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DIBUTYL TEREPHTHALATE

Systematic Name

English

1,4-BENZENEDICARBOXYLIC ACID, 1,4-DIBUTYL ESTER

Systematic Name

English

NSC-6349

Code

English

1,4-BENZENEDICARBOXYLIC ACID, DIBUTYL ESTER

Systematic Name

English

TEREPHTHALIC ACID, DIBUTYL ESTER

Systematic Name

English

BUTYL TEREPHTHALATE

Systematic Name

English

Classification Tree Code System Code

Food Contact Sustance Notif, (FCN No.)

FCN NO. 744

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

Code System Code Type Description

CAS

1962-75-0

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

PRIMARY

ECHA (EC/EINECS)

217-803-9

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

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PUBCHEM

16066

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

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FDA UNII

7O6SH6VN97

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

PRIMARY

NSC

6349

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

PRIMARY

EPA CompTox

DTXSID3022168

Created by admin on Sat Dec 16 08:12:27 GMT 2023 , Edited by admin on Sat Dec 16 08:12:27 GMT 2023

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