(アミノメチル)ホスホン酸

(Aminomethyl)phosphonic acid

HCID 14017CAS 1066-51-9
部分構造検索類似構造を探す

基本情報

標準SMILES
NCP(=O)(O)O
InChIKey
MGRVRXRGTBOSHW-UHFFFAOYSA-N
分子式
CH6NO3P
平均分子量
111.04 g/mol
単同位体質量
111.00852968

概要

(aminomethyl)phosphonic acid is a member of the class of phosphonic acids that is phosphonic acid substituted by an aminomethyl group. It is a metabolite of the herbicide glyphosate. It is a member of phosphonic acids and a one-carbon compound. It is functionally related to a phosphonic acid. It is a conjugate acid of an (aminomethyl)phosphonate(1-).

名称と識別子

優先名称
(Aminomethyl)phosphonic acid
IUPAC
aminomethylphosphonic acid
現地名
(アミノメチル)ホスホン酸
英語名
(Aminomethyl)phosphonic acid
分子式
CH6NO3P
分子量
111.04

名称と別名

(Aminomethyl)phosphonic acid1066-51-9AMINOMETHYLPHOSPHONIC ACID1-Aminomethylphosphonic acidCHEBI:28812NSC-3007690825O5C1UDTXSID5037490RefChem:429439DTXCID3017490623-325-5Aminomethanephosphonic acid
名称をさらに表示
(アミノメチル)ホスホン酸アミノメチルホスホン酸アミノメチルホスホン酸標準品アミノメチルリン酸アミノメチルりん酸標準品アミノメチルりん酸標準液(アミノメチル)りん酸標準物質アミノメチルホスホン酸 (M-547-02)アミノメチルホスホン酸 STANDARD(アミノメチル)ホスホン酸, 99%アミノメチルホスホン酸 (M-547-02), 100 µg/mL in Waterアミノメチルホスホン酸 Standard, 100 µg/mL in Waterアミノメチルホスホン酸, 1000 µg/mL in Water1-アミノメチルホスホン酸AMPAAMINOMETHYLPHOSPHONATEH-GLYP-(OH)2H-AMEPO-(OH)2AMPA 10.0 μg/ml Water(aminomethyl)phosphonicChlorpyrifos Impurity 45Aminomethyanephosphonic Acid
AMePMFCD00008105Phosphonic acid, (aminomethyl)-Amino methane phosphoric acid(1-Aminomethyl)phosphonic acidPhosphaglycineAminomethyl phosphonic acid (AMPA)DG-0043

データベース識別子

CAS
1066-51-9
PubChem CID
14017
DTXSID
DTXSID5037490
ChEMBL
CHEMBL41873
ChEBI
CHEBI:28812
UNII
90825O5C1U
EC Number
623-325-5
Nikkaji
J138.614J

物性

構造計算による物性

XLogP
-4.7
極性表面積
83.6 Ų
水素結合供与体数
3
水素結合受容体数
4
回転可能結合数
1
重原子数
6

実験および物理化学的性質

Pesticides · 3 件

Environmental transformation -> Pesticide transformation products (metabolite, successor)

Pesticide (Aminomethylphosphonic acid (AMPA)) -> USDA PDB

Pesticide degradation product

物理化学的性質

融点
300 °C · 300 °C
沸点
358 · 358.0±44.0 °C(Predicted)
比重(密度)
0.6 · 0.6
貯蔵温度
Keep in dark place,Inert atmosphere,Room temperature
溶解性
50 mg/mL · 水：可溶50mg/mL 無色透明
外見
微結晶性粉末

化学的性質

化学的特性white crystals or powder

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 79.2% (38 of 48) of all reports.

Warning

H315 (12.5%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Chemical: Phosphonic acid, (aminomethyl)-

Regulation (EC) No 178/2002 (amended)

Hazard Classes and CategoriesSkin Irrit. 2 (12.5%)

毒性情報

USGS Health-Based Screening Levels for Evaluating Water-Quality · 5 件

Aminomethylphosphonic acid

62649

Pesticide degradation product

Also see CASRN 1071836

Smith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP

安全データ

F
3-9
wgk
3
ridadr
UN 3261 8/PG 3
hs_code
29319090
risk_code
36/37/38-35-39/23/24/25-20/21/22
hazard_code
Xi,C,T

化学と産業

用途と製造

Use Classification · 2 件

Transformation products

Environmental transformation -> Pesticide transformation products (metabolite, successor)

応用分野 · 2 件

使用(Aminomethyl)phosphonic acid is used in the preparation of (acetylamino-methyl)-phosphonic acid by reacting with acetic anhydride. Further, it is used in the development of immobilized metal affinity chromatography column based on organic-inorganic hybrid silica monolith.

一般的な説明(Aminomethyl)phosphonic acid is a metabolite of amitrole and glyphosate herbicides and was analyzed by HPLC using an electrochemical detector.

上流・下流製品情報

下流製品

サプライヤー50 社

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上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

補足説明

定義ChEBI: A member of the class of phosphonic acids that is phosphonic acid substituted by an aminomethyl group. It is a metabolite of the herbicide glyphosate.

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