ethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

HCID 2736380CAS 20481-15-6

기본 정보

표준 SMILES: CCOC(=O)c1cnc2c(c(C)nn2C)c1Cl
InChIKey: QJXXEUYFFZWYCX-UHFFFAOYSA-N
분자식: C11H12ClN3O2
평균 분자량: 253.68 g/mol
단동위원소 질량: 253.0618043

이름 및 식별자

우선 이름: ethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
IUPAC: ethyl 4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylate
영어명: Ethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
분자식: C11H12ClN3O2
분자량: 253.69

이름 및 동의어

20481-15-6ethyl 4-chloro-1,3-dimethyl-1h-pyrazolo[3,4-b]pyridine-5-carboxylateDTXSID20371320ethyl 4-chloro-1,3-dimethyl-1H-pyrazolo(3,4-b)pyridine-5-carboxylateRefChem:343878DTXCID40322354673-095-5ethyl 4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxylateMFCD000679541H-Pyrazolo[3,4-b]pyridine-5-carboxylic acid, 4-chloro-1,3-dimethyl-, ethyl esterEthyl 4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine 5-carboxylateETHYL4-CHLORO-1,3-DIMETHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE

이름 더 보기

Ethyl 4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine4-chloro-5-ethyl-1,3-dimethylpyrazolo[3,4-b]pyridineethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-car...ETHYL 4-CHLORO-5,7-DIMETHYLPYRAZOLO(3,4-B)PYRIDINE-3-CARBOXYLATEethyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylatEthyl 4-chloro-1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate ,97%

4-Chloro-1,3-Dimethyl-1H-Pyrazolo[3,4-B]Pyridine-5-Carboxylic Acid Ethyl EsterSCHEMBL583418BUTTPARK 30\08-33QJXXEUYFFZWYCX-UHFFFAOYSA-NSBB101302AKOS025117210PB184411H-Pyrazolo[3,4-b]pyridine-5-carboxylicacid, 4-chloro-1,3-dimethyl-, ethyl ester

데이터베이스 식별자

CAS: 20481-15-6
PubChem CID: 2736380
DTXSID: DTXSID20371320
EC Number: 673-095-5
Nikkaji: J2.079.858K

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 57 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 17
형식 전하: 0
복잡도: 302

물리화학적 성질

녹는점: 89 · 89-90°C
끓는 점: 356 · 356.0±37.0 °C(Predicted)
밀도: 1.38 · 1.38±0.1 g/cm3(Predicted)
산도 계수 (pKa): 1.74 · 1.74±0.30(Predicted)

화학적 성질

Ginger solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (50%)

안전 데이터

HS 번호: 29331990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36/37/39
위험 참고 사항: Irritant

화학 및 산업

상·하류 제품 정보

상류 원료

공급사23 곳

郑州汇聚化工有限公司13393710386 · [email protected]

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

武汉凯威斯科技有限公司86-027-67849912 · [email protected]

연결된 노트

불러오는 중…