BISPHENOL A MONOFUMARATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H18O5
Molecular Weight	326.3432
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of BISPHENOL A MONOFUMARATE

Structure Search

SMILES

CC(C)(C1=CC=C(O)C=C1)C2=CC=C(OC(=O)\C=C\C(O)=O)C=C2

InChI

InChIKey=YGVINVPNQKMIAI-VAWYXSNFSA-N

InChI=1S/C19H18O5/c1-19(2,13-3-7-15(20)8-4-13)14-5-9-16(10-6-14)24-18(23)12-11-17(21)22/h3-12,20H,1-2H3,(H,21,22)/b12-11+

HIDE SMILES / InChI

Molecular Formula	C19H18O5
Molecular Weight	326.3432
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:30:06 GMT 2023` Edited by `admin` on `Sat Dec 16 11:30:06 GMT 2023`
Record UNII	ZAE3L80ODK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BISPHENOL A MONOFUMARATE

Systematic Name

English

2-BUTENEDIOIC ACID (2E)-, MONO(4-(1-(4-HYDROXYPHENYL)-1-METHYLETHYL)PHENYL) ESTER

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

303-126-7

Created by admin on Sat Dec 16 11:30:07 GMT 2023 , Edited by admin on Sat Dec 16 11:30:07 GMT 2023

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EPA CompTox

DTXSID30240836

Created by admin on Sat Dec 16 11:30:07 GMT 2023 , Edited by admin on Sat Dec 16 11:30:07 GMT 2023

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FDA UNII

ZAE3L80ODK

Created by admin on Sat Dec 16 11:30:07 GMT 2023 , Edited by admin on Sat Dec 16 11:30:07 GMT 2023

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CAS

94158-54-0

Created by admin on Sat Dec 16 11:30:07 GMT 2023 , Edited by admin on Sat Dec 16 11:30:07 GMT 2023

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PUBCHEM

18469720

Created by admin on Sat Dec 16 11:30:07 GMT 2023 , Edited by admin on Sat Dec 16 11:30:07 GMT 2023

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