PHTHALOFYNE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H14O4
Molecular Weight	246.2586
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PHTHALOFYNE

Structure Search

SMILES

CCC(C)(OC(=O)C1=C(C=CC=C1)C(O)=O)C#C

InChI

InChIKey=CZGIRAWWWHPJHM-UHFFFAOYSA-N

InChI=1S/C14H14O4/c1-4-14(3,5-2)18-13(17)11-9-7-6-8-10(11)12(15)16/h1,6-9H,5H2,2-3H3,(H,15,16)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

PHTHALOFYNE

Official Name

English

1,2-BENZENEDICARBOXYLIC ACID, MONO(1-ETHYL-1-METHYL-2-PROPYNYL) ESTER

Common Name

English

PHTHALOFYNE [USAN]

Common Name

English

NSC-25614

Code

English

ftalofyne [INN]

Common Name

English

PHTHALOFYNE [MI]

Common Name

English

PHTHALOFYNE [GREEN BOOK]

Common Name

English

FTALOFYNE

Official Name

English

FTALOFYNE [MART.]

Common Name

English

Mono(1-ethyl-1-methyl-2-propynyl) phthalate

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C250

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

Code System Code Type Description

EVMPD

SUB07819MIG

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

PRIMARY

NSC

25614

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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SMS_ID

100000080449

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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INN

2277

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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ChEMBL

CHEMBL2107106

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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NCI_THESAURUS

C75230

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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PUBCHEM

8573

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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FDA UNII

TA9XO4D05J

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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CAS

131-67-9

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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DRUG BANK

DB11449

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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MERCK INDEX

m8756

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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Merck Index

EPA CompTox

DTXSID9057634

Created by admin on Fri Dec 15 15:16:15 UTC 2023 , Edited by admin on Fri Dec 15 15:16:15 UTC 2023

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ACTIVE MOIETY


					TA9XO4D05J