1-페닐-2-피라진-2-일레탄온

1-Phenyl-2-pyrazin-2-yl ethanone

HCID 520977CAS 40061-45-8
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(Cc1cnccn1)c1ccccc1
InChIKey
WUYTZBFFXRNJSB-UHFFFAOYSA-N
분자식
C12H10N2O
평균 분자량
198.22 g/mol
단동위원소 질량
198.07931295

이름 및 식별자

우선 이름
1-Phenyl-2-pyrazin-2-yl ethanone
IUPAC
1-phenyl-2-pyrazin-2-ylethanone
현지명
1-페닐-2-피라진-2-일레탄온
영어명
1-Phenyl-2-pyrazin-2-ylethanone
분자식
C12H10N2O
분자량
198.22

이름 및 동의어

1-Phenyl-2-pyrazin-2-yl ethanoneRefChem:435583674-347-71-phenyl-2-pyrazin-2-ylethanone40061-45-81-phenyl-2-(pyrazin-2-yl)ethanone1-phenyl-2-(pyrazin-2-yl)ethan-1-oneMFCD040379061-phenyl-2-pyrazin-2-ylethan-1-onephenacylpyrazinePhenacyl pyrazine1-phenyl-2-pyrazin-2-yl-ethanone
이름 더 보기
1-페닐-2-피라진-2-일레탄온Ethanone, 1-phenyl-2-(2-pyrazinyl)-1-Phenyl-2-(pyrazin-2-yl)ethan-1-one 95+%2-(Benzoylmethyl)-1,4-diazine, 2-Phenacylpyrazine
SCHEMBL1515801DTXSID00334514WUYTZBFFXRNJSB-UHFFFAOYSA-NSBB092299AKOS009157461PS-6001CS-0327449ST51042173

데이터베이스 식별자

CAS
40061-45-8
PubChem CID
520977
DTXSID
DTXSID00334514
EC Number
674-347-7
Nikkaji
J620.974B

물성

구조 계산 물성

XLogP
1.1
극성 표면적
42.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
3
무거운 원자 수
15

물리화학적 성질

녹는점
82 · 82.0-83.0 °C
끓는 점
343.4 · 343.4±27.0 °C(Predicted)
밀도
1.179 · 1.179±0.06 g/cm3(Predicted)
산도 계수 (pKa)
0.51 · 0.51±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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.；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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (50%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (50%)；STOT SE 3 (100%)

안전 데이터

HS 번호
2933998090

화학 및 산업

상·하류 제품 정보

공급사8 곳

武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]

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