3(3-METHOXYPHENYL)-N,N,2-TRIMETHYL PENTANE-1-AMINE HYDROCHLORIDE, (2R,3R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H25NO.ClH
Molecular Weight	271.826
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3(3-METHOXYPHENYL)-N,N,2-TRIMETHYL PENTANE-1-AMINE HYDROCHLORIDE, (2R,3R)-

Structure Search

SMILES

Cl.CC[C@H]([C@@H](C)CN(C)C)C1=CC=CC(OC)=C1

InChI

InChIKey=XKSJVTDZSYZBGF-SBKWZQTDSA-N

InChI=1S/C15H25NO.ClH/c1-6-15(12(2)11-16(3)4)13-8-7-9-14(10-13)17-5;/h7-10,12,15H,6,11H2,1-5H3;1H/t12-,15+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C15H25NO
Molecular Weight	235.3651
Charge	0
Count

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

Molecular Formula	ClH
Molecular Weight	36.461
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 07:59:00 GMT 2023` Edited by `admin` on `Sat Dec 16 07:59:00 GMT 2023`
Record UNII	BPH1EOM45F
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3(3-METHOXYPHENYL)-N,N,2-TRIMETHYL PENTANE-1-AMINE HYDROCHLORIDE, (2R,3R)-

Common Name

English

BENZENEPROPANAMINE, .GAMMA.-ETHYL-3-METHOXY-N,N,.BETA.-TRIMETHYL-, HYDROCHLORIDE (1:1), (.BETA.R,.GAMMA.R)-

Systematic Name

English

(2R,3R)-3(3-METHOXYPHENYL)-N,N,2-TRIMETHYL PENTANE-1-AMINE HYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

24786081

Created by admin on Sat Dec 16 07:59:00 GMT 2023 , Edited by admin on Sat Dec 16 07:59:00 GMT 2023

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EPA CompTox

DTXSID10170001

Created by admin on Sat Dec 16 07:59:00 GMT 2023 , Edited by admin on Sat Dec 16 07:59:00 GMT 2023

PRIMARY

FDA UNII

BPH1EOM45F

Created by admin on Sat Dec 16 07:59:00 GMT 2023 , Edited by admin on Sat Dec 16 07:59:00 GMT 2023

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CAS

175591-17-0

Created by admin on Sat Dec 16 07:59:00 GMT 2023 , Edited by admin on Sat Dec 16 07:59:00 GMT 2023

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3(3-METHOXYPHENYL)-N,N,2-TRIMETHYL PENTANE-1-AMINE, (2R,3R)-

PARENT -> SALT/SOLVATE