Carnitine Chloride

HCID 5970CAS 461-05-2

基本情報

標準SMILES
C[N+](C)(C)CC(O)CC(=O)O.[Cl-]
InChIKey
JXXCENBLGFBQJM-UHFFFAOYSA-N
分子式
C7H16ClNO3
平均分子量
197.66 g/mol
単同位体質量
197.0818711

名称と識別子

優先名称
Carnitine Chloride
IUPAC
(3-carboxy-2-hydroxypropyl)-trimethylazanium chloride

名称と別名

DL-Carnitine hydrochloride461-05-2Carnitine chlorideMonocamind,l-Carnitine hydrochlorideCarnitine chloride [JAN]1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chlorideEINECS 200-305-0EINECS 207-309-1Entomin (TN)Carnitine chloride (JAN)56-99-5
名称をさらに表示
EntominF64264D63NAMMONIUM, (3-CARBOXY-2-HYDROXYPROPYL)TRIMETHYL-, CHLORIDE1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride (1:1)DTXCID6025850CARNITINE HYDROCHLORIDE [WHO-DD]CARNITINE HYDROCHLORIDE [MI]Carnitine DL-HCl

データベース識別子

CAS
461-05-2、461-06-3、56-99-5
PubChem CID
5970
ChEMBL
CHEMBL1439419
EC Number
200-305-0、207-309-1

物性

構造計算による物性

極性表面積
57.5 Ų
水素結合供与体数
2
水素結合受容体数
4
回転可能結合数
4
重原子数
12

実験および物理化学的性質

Solubility>29.6 [ug/mL] (The mean of the results at pH 7.4)
Collision Cross Section132.9 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 13.8% (8 of 58) of reports.

Warning

H315 (86.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (86.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (82.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 58 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 8 of 58 reports by companies.;There are 6 notifications provided by 50 of 58 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 2 件

Chemical: 1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride, (.+-.)-

1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories · 2 件

Skin Irrit. 2 (86.2%);Eye Irrit. 2 (86.2%);STOT SE 3 (82.8%)

Not Classified

法規制情報

Regulatory Information · 2 件

Chemical: 1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride, (.+-.)-

1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

化学と産業

用途と製造

General Manufacturing Information1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride (1:1): ACTIVE

関連反応

14 件

関連ノート

読み込み中…