2-Amino-2-cyanoacetamide (HCID 98341)

이름 및 식별자

우선 이름: 2-Amino-2-cyanoacetamide
IUPAC: 2-amino-2-cyanoacetamide
영어명: 2-Amino-2-cyanoacetamide
분자식: C3H5N3O
분자량: 99.09

이름 및 동의어

2-Amino-2-cyanoacetamide6719-21-7AminocyanoacetamideAcetamide, 2-amino-2-cyano-2-AminocyanoacetamideAminocyanacetamidea-Amino-a-cyanoacetamideEINECS 229-771-3NSC 108868RefChem:85068229-771-3JRWAUKYINYWSTA-UHFFFAOYSA-N

이름 더 보기

ACATIMTEC-BB SBB0015012-Amino-2-cyanacetamid2-cyano-2-aminoacetamide2-Amino-2-cyanoacetamide 97%

3-nitriloalaninamideMFCD00040532(S)-2-Amino-2-cyanoacetamide2091785-71-4NSC1088682-amino-cyanoacetamide2-amino-2cyanoacetamide2-amino-2-cyanacetamide

데이터베이스 식별자

CAS: 6719-21-7
PubChem CID: 98341
DTXSID: DTXSID101313188
EC Number: 229-771-3
Nikkaji: J298.081I

물성

구조 계산 물성

XLogP: -1.8
극성 표면적: 92.9 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 7
형식 전하: 0
복잡도: 121

물리화학적 성질

녹는점: 120 · 120-124 °C
끓는 점: 338.5 · 338.5±37.0 °C(Predicted)
밀도: 1.298 · 1.298±0.06 g/cm3(Predicted)
저장 조건: 20 °C · Store at <= 20°C.
물리적 상태: 가루
산도 계수 (pKa): 17.05 · 17.05±0.50(Predicted)
색상: 베이지부터 황갈색까지
수용성: 녹는
InChI: InChI=1S/C3H5N3O/c4-1-2(5)3(6)7/h2H,5H2,(H2,6,7)
InChIKey: JRWAUKYINYWSTA-UHFFFAOYSA-N
SMILES: C(N)(=O)C(N)C#N

화학적 성질

Beige Powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302+H312+H332 (88.4%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (88.4%)

안전 데이터

wgk: WGK 1 slightly water endangering
독성: LD50 orally in Rabbit: > 2000 mg/kg
HS 번호: 2926 90 70
risk_code: 34-23-51-36-22
hazard_code: T,Xi,Xn
safety_code: 45-36/37/39-26
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 4 DermalAcute Tox. 4 InhalationAquatic Chronic 2Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

개요2-Amino-2-cyanoacetamide, a purine derivative with a diatomic molecule, has been shown to inhibit cancer cells in animals. It has been shown to inhibit the replication of plague virus, an RNA virus that causes encephalitis and other diseases in humans. The nitrogen atom on the molecule is responsible for its transport properties, including intestinal uptake and the ability to cross the blood-brain barrier.2-Amino-2-cyanoacetamide also inhibits the activity of amide hydrolase, an enzyme responsible for the hydrolysis of peptides into amino acids. This process results in reduced protein synthesis, which leads to cell death.

용도2-Amino-2-cyanoacetamide is used as building block in chemical synthesis. Attributes Development Product Contact