4-(트리플루오로메틸)벤자미딘염산염이수화물

4-(Trifluoromethyl)benzene-1-carboximidamide--hydrogen chloride--water (1/1/2)

HCID 44630771

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 175278-62-3
표준 SMILES: Cl.N=C(N)c1ccc(C(F)(F)F)cc1.O.O
InChIKey: ZFGZRQQZWBYRRB-UHFFFAOYSA-N
분자식: C8H12ClF3N2O2
평균 분자량: 260.64 g/mol
단동위원소 질량: 260.0539398

이름 및 식별자

우선 이름: 4-(Trifluoromethyl)benzene-1-carboximidamide--hydrogen chloride--water (1/1/2)
IUPAC: 4-(trifluoromethyl)benzenecarboximidamide;dihydrate;hydrochloride
현지명: 4-(트리플루오로메틸)벤자미딘염산염이수화물
영어명: 4-(TRIFLUOROMETHYL)BENZAMIDINE HYDROCHLORIDE DIHYDRATE
분자식: C8H10ClF3N2O
분자량: 242.63

이름 및 동의어

175278-62-3DTXSID506600174-(Trifluoromethyl)benzene-1-carboximidamide--hydrogen chloride--water (1/1/2)RefChem:289525DTXCID206107664-(Trifluoromethyl)benzamidine hydrochloride dihydrate4-(Trifluoromethyl)benzimidamide hydrochloride dihydrateMFCD00122370C8H12ClF3N2O24-(trifluoromethyl)benzenecarboximidamide;dihydrate;hydrochloride4-(trifluoromethyl)benzene-1-carboximidamide dihydrate hydrochloride4-(Trifluoromethyl)benzene-1-carboximidamide hydrochloride dihydrate

이름 더 보기

4-(트리플루오로메틸)벤자미딘염산염이수화물BUTTPARK 43\57-564-(Trifluoromethyl)benzamidinehydrochloridedihydrate97%4-(Trifluoromethoxy)benzamidine Hydrochloride Dihydrate4-(Trifluoromethyl)benzamidine hydrochloride dihydrate 97%4-(trifluoromethyl)benzenecarboximidamide dihydrate hydrochloride4-(TrifluoroMethyl)benzene-1-carboxiMidaMide hydrochloride hydrate, 97%

4-(trifluoromethyl)benzamidine hydrochloride,dihydrateBenzenecarboximidamide, 4-(trifluoromethyl)-, hydrochloride, hydrate (1:1:2)[amino-[4-(trifluoromethyl)phenyl]methylidene]azanium;chloride;dihydrateSCHEMBL721142SBB102346AKOS015855388FS-4361CS-0206570

데이터베이스 식별자

CAS: 175278-62-3
PubChem CID: 44630771
DTXSID: DTXSID50660017
EC Number: 671-957-5

물성

구조 계산 물성

극성 표면적: 51.9 Å²
수소 결합 공여자 수: 5
수소 결합 수용자 수: 6
회전 가능 결합 수: 1
무거운 원자 수: 16
형식 전하: 0
복잡도: 192

물리화학적 성질

녹는점: 158 °C · 158 °C
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 결정성 분말
색상: 하얀색

화학적 성질

White solid

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 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+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 (50%)；Skin Sens. 1 (50%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (50%)；STOT SE 3 (50%)