PHENOL DEHYDROABIETYLAMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H31N.C6H6O
Molecular Weight	379.5781
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=CC=CC=C1.CC(C)C2=CC3=C(C=C2)[C@@]4(C)CCC[C@@](C)(CN)[C@@H]4CC3

InChI

InChIKey=RHFBOILWUMCCHX-WFBUOHSLSA-N

InChI=1S/C20H31N.C6H6O/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4;7-6-4-2-1-3-5-6/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3;1-5,7H/t18-,19-,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C6H6O
Molecular Weight	94.1112
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:50:49 GMT 2025` Edited by `admin` on `Mon Mar 31 22:50:49 GMT 2025`
Record UNII	T4NSQ4XKJ6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PHENOL DEHYDROABIETYLAMINE

Common 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 PHENOL (1:1)

Preferred Name

English

DEHYDROABIETYLAMMONIUM PHENOXIDE

Common Name

English

PHENOL, COMPD. WITH (1R,4AS,10AR)-1,2,3,4,4A,9,10,10A-OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-1-PHENANTHRENEMETHANAMINE (1:1)

Common Name

English

PHENOL DEHYDROABIETYLAMINE SALT

Common Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

4212