Propargylamine

HCID 239041CAS 2450-71-7

기본 정보

표준 SMILES: C#CCN
InChIKey: JKANAVGODYYCQF-UHFFFAOYSA-N
분자식: C3H5N
평균 분자량: 55.08 g/mol
단동위원소 질량: 55.04219916

이름 및 식별자

우선 이름: Propargylamine
IUPAC: prop-2-yn-1-amine

이름 및 동의어

Propargylamine2450-71-72-Propyn-1-amineDTXSID30862951propinylamineRefChem:869620DTXCID50811648219-513-82-PROPYNYLAMINEprop-2-yn-1-amine3-Aminopropynepropargyl amine

이름 더 보기

3-Amino-1-propyneProp-2-ynylamineMFCD000081983-Aminoprop-1-ynepropargylaminpro-pargylaminemonopropargylamineamino-2-propyne

데이터베이스 식별자

CAS: 2450-71-7
PubChem CID: 239041
DTXSID: DTXSID30862951
ChEMBL: CHEMBL3263480
EC Number: 219-513-8
Nikkaji: J3.030I

물성

구조 계산 물성

XLogP: -0.4
극성 표면적: 26 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 4
형식 전하: 0
복잡도: 38

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H310 (98.2%): Fatal in contact with skin [Danger Acute toxicity, dermal]；H314 (92.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (64.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P210, P233, P240, P241, P242, P243, P260, P262, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 168 reports by companies from 10 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.