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비신

Bicine

HCID 8761
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기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
150-25-4
표준 SMILES
O=C(O)CN(CCO)CCO
InChIKey
FSVCELGFZIQNCK-UHFFFAOYSA-N
분자식
C6H13NO4
평균 분자량
163.17 g/mol
단동위원소 질량
163.0844579

개요

N,N-bis(2-hydroxyethyl)glycine is a bicine that is a Good's buffer substance, pKa = 8.35 at 20 C. It is a conjugate acid of a [bis(2-hydroxyethyl)amino]acetate. It is a tautomer of a [bis(2-hydroxyethyl)ammonio]acetate.

이름 및 식별자

우선 이름
Bicine
IUPAC
2-[bis(2-hydroxyethyl)amino]acetic acid
현지명
비신
영어명
Bicine
분자식
C6H13NO4
분자량
163.17

이름 및 동의어

Bicine150-25-4N,N-Bis(2-hydroxyethyl)glycineDiethylolglycineDiethanol glycineDihydroxyethylglycineBiceneGlycine, N,N-bis(2-hydroxyethyl)-2-(bis(2-hydroxyethyl)amino)acetic acidN,N-Dihydroxyethyl glycineN,N-DihydroxyethylglycineDHEG
이름 더 보기
비신N,N-비스(2-하이드록시에틸)글리신BICINE BUFFERN,N-DI(2-HYDROXYETHYL)GLYCINEBIClNEBicirneBiobufferBICINE, 99+%1.0 M BICINEFe-3-Specific
2-[bis(2-hydroxyethyl)amino]acetic aciddi(hydroxyethyl)glycine1J484QFI1ONSC-7342NSC-7512CHEBI:40957RefChem:568038CHEBI:39065

데이터베이스 식별자

CAS
150-25-4
PubChem CID
8761
DTXSID
DTXSID3041669
ChEMBL
CHEMBL1231251
ChEBI
CHEBI:40957
UNII
1J484QFI1O
EC Number
205-755-1
Nikkaji
J39.915I

물성

구조 계산 물성보충 중

XLogP
-3.8
극성 표면적
81 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
5
회전 가능 결합 수
6
무거운 원자 수
11
형식 전하
0
복잡도
111

실험 및 물리화학적 성질

Chemical ClassesOther Uses -> Biological Buffers
DrugsPharmaceuticals -> Listed in ZINC15
Physical Description · 2건

Solid; [Merck Index] White crystalline powder; [Alfa Aesar MSDS]

Solid

물리화학적 성질

녹는점
190 °C · 190 °C (dec.)(lit.)
끓는 점
290.25 °C · 290.25°C (rough estimate)
밀도
1.05 g/mL · 1.05 g/mL at 20 °C
증기압
0.002 · 0.002-0.007Pa at 20-25℃
굴절률
1.424 · 1.4240 (estimate)
저장 조건
room temp
용해도
2 O: · H2O: 1 M at 20 °C, 투명, 무색
물리적 상태
가루
색상
하얀색
수소이온지수(pH)
4 · 4.0-5.5 (25℃, 1M in H2O)
산도 계수 (pKa)
8.3 · 8.3(at 25℃)
수용성
녹는
Merck

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 97.6% (124 of 127) of all reports.

Not Classified

Aggregated GHS information provided per 127 reports by companies from 4 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 3건

Chemical: Glycine, N,N-bis(2-hydroxyethyl)-

Status: Active Update: 23-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23693

Glycine, N,N-bis(2-hydroxyethyl)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazards SummaryCauses changes in tubules (including acute renal failure and necrosis) in intraperitoneal lethal-dose studies of mice (LD50 = 1,540 mg/kg); [RTECS] May cause irritation; [Alfa Aesar MSDS] See Glycine.
Hazard Classes and CategoriesNot Classified

독성 정보

Adverse EffectsNephrotoxin - The chemical is potentially toxic to the kidneys in the occupational setting.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
MB9700000
독성
mouse,LD50,intraperitoneal,1540mg/kg (1540mg/kg),KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)",Revue d'Epidemiologie, Medecine Sociale et Sante Publique. Vol. 10, Pg. 391, 1962.

화학 및 산업

약리 정보

Tissue LocationsProstate

용도 및 제조

UsesUsed as a buffer and chelating agent; [Merck Index] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
General Manufacturing InformationGlycine, N,N-bis(2-hydroxyethyl)-: ACTIVE
응용 분야 · 2건

개요Bicine is an amino acid that results from amine degradation due to the presence of oxygen and/or sulfur dioxide. The amine solvents that undergo this degradation are MDEA, DEA, TEA, and mixed amine solvents containing any of these amines. As a zwitterionic amino acid buffer agent, bicine is active in the pH 7.6-9.0 range (pKa of 8.26 at 25°C). Bicine is a recommended buffer for low-temperature biochemical work. It is used for the preparation of stable substrate solution for serum guanase determination. It can be used as a nitrogenous strength enhancer to regulate cement hydration and improve cement properties. Studies have found that bicine significantly changes the morphology of portlandite crystals from a parallel-stacked lamellar shape to a distorted one and also decreases the pore size of the hardened cement paste at an early age[1]. In particular, bicine could promote the rapid formation of β-sheet-rich amyloid-β fibrils[2].

용도A zwitterionic amino acid buffer agent used for low temperature work. The use of bicine in a thin layer ion exchange chromatography method for protein resolution has been published. Bicine has been utilized in peptide and protein crystallization. A kinetic study of a quaternary transition-state analogue complex of creatine kinase used bicine in the reaction buffer. A multiphasic buffer system for SDS-PAGE of proteins and peptides that incorporates bicine has been described.

관련 반응

12건
반응 기록 만들기
HRID 247013 반응식
HRID 247013반응물로uspto-grants-1987_11
HRID 439597 반응식
HRID 439597생성물로uspto-grants-1996_05
HRID 439598 반응식
HRID 439598반응물로uspto-grants-1996_05
HRID 479843 반응식
HRID 479843생성물로uspto-grants-2003_11
HRID 1081286 반응식
HRID 1081286생성물로uspto-grants-1996_12
HRID 1081287 반응식
HRID 1081287반응물로uspto-grants-1996_12
HRID 1735660 반응식
HRID 1735660반응물로uspto-grants-1996_07
HRID 1899865 반응식
HRID 1899865생성물로uspto-grants-1996_11
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화합물 노트

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이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
14 · 14,1201
BRN
1769362 · 1769362
InChI
1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11)
InChIKey
FSVCELGFZIQNCK-UHFFFAOYSA-N
SMILES
OCCN(CCO)CC(O)=O
LogP
2.3 at · 2.3 at 20℃ and pH7
표면장력
72.2 mN/m · 72.2mN/m at 1g/L and 20℃
EPA
Bicine (150-25-4)
Absorption
0.05 at · ≤0.05 at 260 in H2O at 1M≤0.05 at 280 in H2O at 1M
화학적 성질 · 1건

Bicine is a white/clear crystalline powder that is somewhat soluble in water. It contains an amino group, carboxyl group, and two hydroxyl units in its structure, making it highly polar. It is often used as a biological buffer and chelating agent.

HS 번호
29225000
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
24/25-36-26
기존화학 물질
2013-3-5652
F 고인화성물질
3-10
스토리지 클래스
11 - Combustible Solids