1,5-디메틸-2-피페리돈

2-Piperidinone, 1,5-dimethyl-

HCID 159027

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 86917-58-0
표준 SMILES: CC1CCC(=O)N(C)C1
InChIKey: YXHVIDNQBMVYHQ-UHFFFAOYSA-N
분자식: C7H13NO
평균 분자량: 127.18 g/mol
단동위원소 질량: 127.09971404

이름 및 식별자

우선 이름: 2-Piperidinone, 1,5-dimethyl-
IUPAC: 1,5-dimethylpiperidin-2-one
현지명: 1,5-디메틸-2-피페리돈
영어명: 1,5-Dimethyl-2-piperidone
분자식: C7H13NO
분자량: 127.18

이름 및 동의어

1,5-Dimethyl-2-piperidone86917-58-02-Piperidinone, 1,5-dimethyl-DTXSID10888679RefChem:478294DTXCID501027955679-997-51,5-dimethylpiperidin-2-oneMFCD03701098SCHEMBL583977AKOS015850788SY052843

이름 더 보기

1,5-디메틸-2-피페리돈1,5-Dimethyl-2-piperidone>1,5-Dimethyl-piperidin-2-one

CS-0358054D2753D90110F750408

데이터베이스 식별자

CAS: 86917-58-0
PubChem CID: 159027
DTXSID: DTXSID10888679
EC Number: 679-997-5
Nikkaji: J1.326.056G

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 20.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 122

물리화학적 성질

끓는 점: 232.6 °C · 232.6 °C
밀도: 0.949 · 0.949±0.06 g/cm3(Predicted)
인화점: 94 °C · 94 °C
물리적 상태: 투명한 액체
산도 계수 (pKa): -0.37 · -0.37±0.40(Predicted)
색상: 무색~연황색
EPA: 2 · 2-Piperidinone, 1,5-dimethyl- (86917-58-0)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Piperidinone, 1,5-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

규제 정보

Regulatory Information · 2건

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Piperidinone, 1,5-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.