(3-Methyloxiran-2-yl)phosphonic acid benzylamine

Details

Stereochemistry	MIXED
Molecular Formula	C7H9N.C3H7O4P
Molecular Weight	245.2121
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (3-Methyloxiran-2-yl)phosphonic acid benzylamine

Structure Search

SMILES

CC1OC1P(O)(O)=O.NCC2=CC=CC=C2

InChI

InChIKey=YFOCHWJDRUXOIQ-UHFFFAOYSA-N

InChI=1S/C7H9N.C3H7O4P/c8-6-7-4-2-1-3-5-7;1-2-3(7-2)8(4,5)6/h1-5H,6,8H2;2-3H,1H3,(H2,4,5,6)

HIDE SMILES / InChI

Molecular Formula	C7H9N
Molecular Weight	107.1531
Charge	0
Count

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

Molecular Formula	C3H7O4P
Molecular Weight	138.059
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:45:45 GMT 2025` Edited by `admin` on `Wed Apr 02 17:45:45 GMT 2025`
Record UNII	54S3Y4AK33
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(3-Methyloxiran-2-yl)phosphonic acid benzylamine

Systematic Name

English

(3-Methyloxiran-2-yl)phosphonic acid phenylmethanamine

Preferred Name

English

Benzylamine, (1,2-epoxypropyl)phosphonate, (±)-

Systematic Name

English

Phosphonic acid, (1,2-epoxypropyl)-, compd. with benzylamine, (±)-

Systematic Name

English

Code System Code Type Description

CAS

27699-10-1

Created by admin on Wed Apr 02 17:45:45 GMT 2025 , Edited by admin on Wed Apr 02 17:45:45 GMT 2025

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FDA UNII

54S3Y4AK33

Created by admin on Wed Apr 02 17:45:45 GMT 2025 , Edited by admin on Wed Apr 02 17:45:45 GMT 2025

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PUBCHEM

75086451

Created by admin on Wed Apr 02 17:45:45 GMT 2025 , Edited by admin on Wed Apr 02 17:45:45 GMT 2025

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P-(3-Methyl-2-oxiranyl)phosphonic acid

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Amount: