Partially neutralized sodium salt of bis hexamethylene triamine penta (methylene phosphonic acid) ( (CAS 35657-77-3)

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Partially neutralized sodium salt of bis hexamethylene triamine penta (methylene phosphonic acid) (. CAS 35657-77-3.

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化学概述: Phosphonic acid, P,P',P'',P'''-(((phosphonomethyl)imino)bis(6,1-hexanediylnitrilobis(methylene)))tetrakis-, sodium salt (1:?)
分子式C₁₇H₄₄N₃O₁₅P₅[1]
分子量708.4 g/mol[1]
IUPAC名称sodium [bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid[1]
SMILESC(CCCN(CP(=O)(O)O)CP(=O)(O)O)CCN(CCCCCCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O.[Na+][1]
InChIKeyJVSATRWQUPAOHA-UHFFFAOYSA-N[1]

同义词: 35657-77-3 · Dihexylenetriaminepentakismethylenephosphonic acid, sodium salt · EINECS 252-656-4 · RefChem:173583 · sodium;[bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid

数据来源: PubChem (NLM/NIH)
最后更新: 2026-09-03

📚 科学参考文献(芝加哥作者-日期格式) (1 来源)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. applies to: 分子式 · 分子量 · IUPAC名称 · SMILES · InChIKey

科学研究

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MOLECULE 按CAS号参考文献(实时来自13+数据库)

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物质监管状态
在已检查的限制清单(SVHC候选清单、REACH附件XVII;数据集不完整——这不构成合规确认)中未找到该CAS号的条目。CLP分类和运输状态(ADR):请参见GHS章节及安全数据表(SDS)。
🧪 化学数据
CAS号
35657-77-3
分子式
C₁₇H₄₄N₃O₁₅P₅
摩尔质量
708.4 g/mol
IUPAC名称 (EN)
sodium [bis[6-[bis(phosphonomethyl)amino]hexyl]amino]methylphosphonic acid
SMILES
C(CCCN(CP(=O)(O)O)CP(=O)(O)O)CCN(CCCCCCN(CP(=O)(O)O)CP(=O)(O)O)CP(=O)(O)O.[Na+]
InChIKey
JVSATRWQUPAOHA-UHFFFAOYSA-N
🔍 外部标识符
6 / 16个ID系统38%
数据库标识符操作
CAS Registry Number35657-77-3打开 →
PubChem CID161882[1]打开 →
InChIKeyJVSATRWQUPAOHA-UHFFFAOYSA-N[1]打开 →
SMILESC(CCCN(CP(=O)(O)O)CP(=O)(O)O)CCN(CCCCCCN(CP(=O)(…[1]
EC Number252-656-4[2]打开 →
WikiData QIDQ72443335打开 →

来源:PubChem (NIH)、Wikidata SPARQL、KEGG、ChEMBL (EBI)、CompTox CTX (EPA)。

📚 科学参考文献(芝加哥作者-日期格式) (2 来源)
  1. PubChem. National Center for Biotechnology Information (NIH/NLM), chemical compound database. applies to: PubChem CID · InChIKey · SMILES
  2. ECHA. EC Inventory — EINECS, ELINCS, NLP and List Numbers assigned under REACH. Helsinki: European Chemicals Agency. applies to: EC Number

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Partially neutralized sodium salt of bis hexamethylene triamine penta (methylene phosphonic acid) ( — CAS 35657-77-3. Listed by Shandong Yuanlian. Prepared from the supplier’s public catalogue; not verified against their internal data.

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