2-아미노-5-메틸-1,3,4-티아디아졸

1,3,4-Thiadiazole, 2-amino-5-methyl-

HCID 66949CAS 108-33-8

기본 정보

표준 SMILES
Cc1nnc(N)s1
InChIKey
HMPUHXCGUHDVBI-UHFFFAOYSA-N
분자식
C3H5N3S
평균 분자량
115.16 g/mol
단동위원소 질량
115.02041835

이름 및 식별자

우선 이름
1,3,4-Thiadiazole, 2-amino-5-methyl-
IUPAC
5-methyl-1,3,4-thiadiazol-2-amine
현지명
2-아미노-5-메틸-1,3,4-티아디아졸
영어명
2-Amino-5-methyl-1,3,4-thiadiazole
분자식
C3H5N3S
분자량
115.16

이름 및 동의어

2-Amino-5-methyl-1,3,4-thiadiazole5-Methyl-1,3,4-thiadiazol-2-amine1,3,4-Thiadiazol-2-amine, 5-methyl-2-Amino-5-methylthiadiazoleUSAF CY-31,3,4-Thiadiazole, 2-amino-5-methyl-5-Methyl-1,3,4-thiadiazole-2-amine5-Methyl-1,3,4-thiadiazol-2-ylamineEINECS 203-573-71,4-Thiadiazol-2-amine, 5-methyl-AI3-611632-Methyl-5-amino-1,3,4-thiadiazole
이름 더 보기
2-아미노-5-메틸-1,3,4-티아디아졸usafcy-3TOSLAB 27625AKOS BBS-00007966VITAS-BB TBB000116TIMTEC-BB SBB0000454-thiadiazol-2-amine,5-methyl-34-thiadiazole,2-amino-5-methyl-3
NSC 137228DTXSID70148347RefChem:412399DTXCID30708381,3,4-Thiadiazol-2-amine, 5-methyl-(9CI)203-573-7108-33-8MATD

데이터베이스 식별자

CAS
108-33-8
PubChem CID
66949
DTXSID
DTXSID70148347
ChEMBL
CHEMBL1288960
ChEBI
CHEBI:194873
UNII
NC799929EM
EC Number
203-573-7
Nikkaji
J38.372D

물성

구조 계산 물성

XLogP
0.4
극성 표면적
80 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
0
무거운 원자 수
7

실험 및 물리화학적 성질

Solubility>17.3 [ug/mL] (The mean of the results at pH 7.4)

물리화학적 성질

녹는점
223 · 223-228 °C
끓는 점
261.2 · 261.2±23.0 °C(Predicted)
밀도
1.287 · 1.287 (estimate)
굴절률
1.58 · 1.5800 (estimate)
저장 조건
Keep in dark place,Inert atmosphere,Room temperature
용해도
DMSO(적게), 메탄올(약간)에 용해됨

화학적 성질

White to light beige crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (97.7%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 44 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (97.7%);Skin Irrit. 2 (100%);Eye Irrit. 2 (100%);STOT SE 3 (97.7%)

안전 데이터

wgk
3
rtecs
XI3500000
HS 번호
29349990
risk_code
36/37/38
hazard_code
Xi
safety_code
24/25-37/39-26

화학 및 산업

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

관련 반응

74건

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