이미노 디초산

이미노디초산 · 이미노다이아세트산 · 2,2'-이미노비스아세트산 · IDA · 2,2'-azanediyldiacetic acid · Aminodiacetic acid · 2,2’-iminobis-aceticaci · diglykokoll

https://huagongshe.com/ko/chemical/8897

식별자 및 물리적 특성

CAS No.	142-73-4
분자식	C4H7NO4
평균 분자량	133.1 g/mol
단동위원소 질량	133.0375077 g/mol
SMILES	O=C(O)CNCC(=O)O
InChIKey	NBZBKCUXIYYUSX-UHFFFAOYSA-N
PubChem CID	8897
ChEMBL	CHEMBL461164
ChEBI	CHEBI:24786
EC No.	205-555-4
DTXSID	DTXSID2027098
현지명	이미노 디초산

화학 및 물리적 성질

XLogP	-3.3
극성 표면적	86.6
수소 결합 공여자 수	3
수소 결합 수용자 수	5
회전 가능 결합 수	4
무거운 원자 수	9
형식 전하	0
복잡도	108
물질 분류	Other Uses -> Chelating Agents
Color/Form	ORTHORHOMBIC CRYSTALS
용해도	PRACTICALLY INSOL IN ACETONE, METHANOL, ETHER, BENZENE, CARBON TETRACHLORIDE, HEPTANESOL IN WATER @ 5 °C: 2.43 G/100 ML42g/L
녹는점	247.50 °C. @ 760.00 mm Hg243 °C (dec.) (lit.)
Physical Description	Dry PowderSolid[Merck Index] Light brown crystalline solid[MSDSonline]
Dissociation Constants	PKA1: 2.98PKA2: 9.89
Other Experimental Properties	FORMS SALTS WITH ACIDS & BASES220-250 °C (COMMERCIAL)DECOMP @ 247.5 °C
끓는 점	245.59°C (rough estimate)
밀도	1.5325 (rough estimate)
굴절률	1.4540 (estimate)
저장 조건	Store below +30°C.
물리적 상태	결정성 분말
pKa(산도 계수)	2.98, 9.89(at 25℃)
색상	흰색 또는 노란색
pH	2.2-2.3 (H2O, 20℃)(saturated solution)
용해도	2.43g/100mL(5℃)
Merck	14,4917
BRN	878499
주요 응용	펩타이드 합성
InChI	1S/C4H7NO4/c6-3(7)1-5-2-4(8)9/h5H,1-2H2,(H,6,7)(H,8,9)
InChIKey	NBZBKCUXIYYUSX-UHFFFAOYSA-N
SMILES	OC(=O)CNCC(O)=O
LogP(분배 계수)	1.840 (est)
NIST	Glycine, N-(carboxymethyl)-(142-73-4)
EPA	Glycine, N-(carboxymethyl)- (142-73-4)

화학적 성질

white or yellowish crystalline powder

안전 및 규제

GHS 분류	This chemical does not meet GHS hazard criteria for 20.1% (55 of 274) of reports.WarningH315 (56.9%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P273, 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 274 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Chemical: Glycine, N-(carboxymethyl)-Glycine, N-(carboxymethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Glycine, N-(carboxymethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Iminodiacetic acid: Does not have an individual approval but may be used under an appropriate group standard
유해성 요약	Emergency medical treatment: symptomatic drug ingestionNot tumorigenic when 0.5% solution added to drinking water of rats for most of their lifespans[HSDB] Intraperitoneal LD50 (mouse) = 250 mg/kg[RTECS] An irritant[MSDSonline]
Hazard Classes and Categories	Skin Irrit. 2 (56.9%)
Protective Action Criteria (PAC)	0.82 [mg/m3]9.0 [mg/m3]54 [mg/m3]
Non-Human Toxicity Excerpts	NO TUMORIGENICITY IN RATS GIVEN 0.5% IMINODIACETIC ACID IN DRINKING WATER, WITH OR WITHOUT NANO2 OR NANO3, FOR MOST OF THEIR LIFESPANS. DOSE WAS 20 ML SOLN/ANIMAL 5 DAYS A WK.
수질 위해 등급(WGK)	1
TSCA 등재 상태	TSCA listed
RTECS 번호	AI2975000
독성	LD50 orally in Rabbit: > 2000 mg/kg
관세 코드	29224995

용도

Iminodiacetic acid can be used:In the preparation of iminodiacetic acid (IDA)-type adsorbent for protein purification.As a catalyst along with iron (FeCl3) complexes for methyl methacrylate (MMA) polymerization. In the preparation of chelating resins with glycidyl methacrylate for the selective removal and recovery of metal ions from industrial waste water.As a reagent for the preparation of pinene-derived iminodiacetic acid (PIDA), which is in turn used as a ligand for the synthesis of diastereoselective oxiranyl C(sp3) boronates from the corresponding olefins.In the surface functionalization of multi-walled carbon nanotubes (MWCNTs) which is further utilized as a sorbent for the separation of heavy metal ions.