U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C20H31N.C6HCl5O
Molecular Weight 551.803
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEHYDROABIETYLAMMONIUM PENTACHLOROPHENOXIDE

SMILES

OC1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl.[H][C@@]23CCC4=CC(=CC=C4[C@@]2(C)CCC[C@@]3(C)CN)C(C)C

InChI

InChIKey=FQHFSZCYOUJICQ-WFBUOHSLSA-N
InChI=1S/C20H31N.C6HCl5O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4;7-1-2(8)4(10)6(12)5(11)3(1)9/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3;12H/t18-,19-,20+;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DEHYDROABIETYLAMMONIUM PENTACHLOROPHENOXIDE
Common Name English
CASWELL NO. 277A
Common Name English
FUNGAMIN
Common Name English
PHENOL, 2,3,4,5,6-PENTACHLORO-, COMPD. WITH (1R,4AS,10AR)-1,2,3,4,4A,9,10,10A-OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-1-PHENANTHRENEMETHANAMINE (1:1)
Systematic Name English
1-PHENANTHRENEMETHANAMINE, 1,2,3,4,4A,9,10,10A-OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-, (1R-(1.ALPHA.,4A.BETA.,10A.ALPHA.))-, COMPD. WITH PENTACHLOROPHENOL (1:1)
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 4202
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
Code System Code Type Description
PUBCHEM
121225229
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
PRIMARY
FDA UNII
D0Q6F9QA0X
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
PRIMARY
ECHA (EC/EINECS)
252-371-5
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
PRIMARY
CAS
35109-57-0
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
PRIMARY
EPA CompTox
DTXSID70895147
Created by admin on Sat Dec 16 10:59:18 GMT 2023 , Edited by admin on Sat Dec 16 10:59:18 GMT 2023
PRIMARY