RHUBAFURAN

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NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C12H16O
Molecular Weight	176.2548
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of RHUBAFURAN

Structure Search

SMILES

CC1CC(C)(CO1)C2=CC=CC=C2

InChI

InChIKey=GPMLJOOQCIHFET-UHFFFAOYSA-N

InChI=1S/C12H16O/c1-10-8-12(2,9-13-10)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C12H16O
Molecular Weight	176.2548
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:28:59 GMT 2023` Edited by `admin` on `Sat Dec 16 12:28:59 GMT 2023`
Record UNII	85JUZ61OL5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

RHUBAFURAN

Common Name

English

FURAN, TETRAHYDRO-2,4-DIMETHYL-4-PHENYL-

Systematic Name

English

2,4-DIMETHYL-4-PHENYLTETRAHYDROFURAN

Systematic Name

English

Code System Code Type Description

PUBCHEM

113514

Created by admin on Sat Dec 16 12:28:59 GMT 2023 , Edited by admin on Sat Dec 16 12:28:59 GMT 2023

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FDA UNII

85JUZ61OL5

Created by admin on Sat Dec 16 12:28:59 GMT 2023 , Edited by admin on Sat Dec 16 12:28:59 GMT 2023

PRIMARY

ECHA (EC/EINECS)

279-967-8

Created by admin on Sat Dec 16 12:28:59 GMT 2023 , Edited by admin on Sat Dec 16 12:28:59 GMT 2023

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EPA CompTox

DTXSID4051401

Created by admin on Sat Dec 16 12:28:59 GMT 2023 , Edited by admin on Sat Dec 16 12:28:59 GMT 2023

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CAS

82461-14-1

Created by admin on Sat Dec 16 12:28:59 GMT 2023 , Edited by admin on Sat Dec 16 12:28:59 GMT 2023

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