벤젠메탄올,-알파-(1-아미노에틸)-

벤젠메탄올,-알파-(1-아미노에틸)- · α-(1-Aminoethyl)benzenemethanol · Benzenemethanol, α-(1-aminoethyl)- · Benzenemethanol, -alpha--(1-aminoethyl)-

https://huagongshe.com/ko/chemical/4786

식별자 및 물리적 특성

CAS No.	37577-28-9
분자식	C9H13NO
평균 분자량	151.21 g/mol
단동위원소 질량	151.09971404 g/mol
SMILES	CC(N)C(O)c1ccccc1
InChIKey	DLNKOYKMWOXYQA-UHFFFAOYSA-N
PubChem CID	4786
EC No.	628-077-1
DTXSID	DTXSID70859305
현지명	벤젠메탄올,-알파-(1-아미노에틸)-

화학 및 물리적 성질

XLogP	0.8
극성 표면적	46.3
수소 결합 공여자 수	2
수소 결합 수용자 수	2
회전 가능 결합 수	2
무거운 원자 수	11
형식 전하	0
복잡도	110
의약품	DEA NFLIS-Drug Category -> Phenethylamines (Amphetamines) (S)Pharmaceuticals
녹는점	103 °C
끓는 점	122 °C(Press: 4-5 Torr)
밀도	1.071±0.06 g/cm3(Predicted)
pKa(산도 계수)	12.07±0.45(Predicted)

안전 및 규제

GHS 분류	WarningH302 (100%): 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Acute Tox. 4 (100%)

GHS 분류

WarningH302 (100%): 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard Classes and Categories

Acute Tox. 4 (100%)