Ethyl 1-methylpiperidine-2-carboxylate

HCID 566742CAS 30727-18-5

기본 정보

표준 SMILES: CCOC(=O)C1CCCCN1C
InChIKey: ZICBNHLULHJETL-UHFFFAOYSA-N
분자식: C9H17NO2
평균 분자량: 171.24 g/mol

이름 및 식별자

우선 이름: Ethyl 1-methylpiperidine-2-carboxylate
IUPAC: ethyl 1-methylpiperidine-2-carboxylate

이름 및 동의어

Ethyl 1-methylpiperidine-2-carboxylateEthyl 1-methyl-2-piperidinecarboxylateEINECS 250-311-2RefChem:593354250-311-230727-18-5Ethyl 1-methylpipecolinateEthyl 1-MethylpipecolateMFCD000064922-Piperidinecarboxylic acid, 1-methyl-, ethyl ester1-Methylpipecolic Acid Ethyl EsterEthyl Methylpiperidine-2-carboxylate

이름 더 보기

Ethyl N-methylpipecolinateEthyl1-methylpipecolinate1-Methyl-2-piperidinecarboxylic Acid Ethyl EsterSCHEMBL6521602-Carbethoxy-N-methylpiperidineZICBNHLULHJETL-UHFFFAOYSA-1-Methylpipecolinic Acid Ethyl EsterBBL027588

데이터베이스 식별자

CAS: 30727-18-5
PubChem CID: 566742
EC Number: 250-311-2
Nikkaji: J236.506E

물성

구조 계산 물성

XLogP: 1.4
극성 표면적: 29.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 12
형식 전하: 0
복잡도: 159

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (97.5%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory.