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Details

Stereochemistry RACEMIC
Molecular Formula C10H10O3
Molecular Weight 178.1846
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1'-HYDROXYSAFROLE

SMILES

OC(C=C)C1=CC2=C(OCO2)C=C1

InChI

InChIKey=VVBJNJFYBCLUAH-UHFFFAOYSA-N
InChI=1S/C10H10O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h2-5,8,11H,1,6H2

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity studies of the hepatocarcinogenicities of alkenylbenzene derivatives related to estragole and safrole on administration to preweanling male C57BL/6J x C3H/HeJ F1 mice.
1987 May 1
Name Type Language
1'-HYDROXYSAFROLE
HSDB  
Systematic Name English
.ALPHA.-VINYL-1,3-BENZODIOXOLE-5-METHANOL
Systematic Name English
2-(3,4-METHYLENEDIOXYPHENYL)ALLYL ALCOHOL
Systematic Name English
1'-HYDROXYSAFROLE [HSDB]
Common Name English
1,3-BENZODIOXOLE-5-(2-PROPEN-1-OL)
Common Name English
1'-HYDROXYISOSAFROLE
Systematic Name English
1,2-METHYLENEDIOXY-4-(1-HYDROXYALLYL)BENZENE
Systematic Name English
PIPERONYL ALCOHOL, .ALPHA.-VINYL-
Systematic Name English
1,3-BENZODIOXOLE-5-METHANOL, .ALPHA.-ETHENYL-
Systematic Name English
.ALPHA.-ETHENYL-1,3-BENZODIOXOLE-5-METHANOL
Systematic Name English
Code System Code Type Description
PUBCHEM
21268
Created by admin on Sat Dec 16 08:32:52 GMT 2023 , Edited by admin on Sat Dec 16 08:32:52 GMT 2023
PRIMARY
CAS
5208-87-7
Created by admin on Sat Dec 16 08:32:52 GMT 2023 , Edited by admin on Sat Dec 16 08:32:52 GMT 2023
PRIMARY
HSDB
3492
Created by admin on Sat Dec 16 08:32:52 GMT 2023 , Edited by admin on Sat Dec 16 08:32:52 GMT 2023
PRIMARY
FDA UNII
C9B19855E2
Created by admin on Sat Dec 16 08:32:52 GMT 2023 , Edited by admin on Sat Dec 16 08:32:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID0020731
Created by admin on Sat Dec 16 08:32:52 GMT 2023 , Edited by admin on Sat Dec 16 08:32:52 GMT 2023
PRIMARY