DEHYDROABIETYLAMMONIUM PENTACHLOROPHENOXIDE

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

Structure Search

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

Molecular Formula	C20H31N
Molecular Weight	285.4668
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C6HCl5O
Molecular Weight	266.337
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:59:18 GMT 2023` Edited by `admin` on `Sat Dec 16 10:59:18 GMT 2023`
Record UNII	D0Q6F9QA0X
Record Status	`Validated (UNII)`
Record Version

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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