1-Amino-4-bromo-2-methylanthraquinone

HCID 66480CAS 81-50-5

기본 정보

표준 SMILES: Cc1cc(Br)c2c(c1N)C(=O)c1ccccc1C2=O
InChIKey: VIQMJMDPUIBXQO-UHFFFAOYSA-N
분자식: C15H10BrNO2
평균 분자량: 316.15 g/mol
단동위원소 질량: 314.98949

이름 및 식별자

우선 이름: 1-Amino-4-bromo-2-methylanthraquinone
IUPAC: 1-amino-4-bromo-2-methylanthracene-9,10-dione
영어명: 1-AMINO-4-BROMO-2-METHYLANTHRAQUINONE
분자식: C15H10BrNO2
분자량: 316.15

이름 및 동의어

1-Amino-4-bromo-2-methylanthraquinone1-Amino-2-methyl-4-bromoanthraquinoneAnthraquinone, 1-amino-4-bromo-2-methyl-9,10-Anthracenedione, 1-amino-4-bromo-2-methyl-K495LUA00REINECS 201-355-61-Amino-4-bromo-2-methyl-9,10-anthracenedioneNSC 401160NSC-4011604-Bromo-2-methyl-1-anthraquinonylamineDTXSID10588481-Amino-3-bromo-2-methyl-9,10-anthraquinone

이름 더 보기

TIMTEC-BB SBB002955LABOTEST-BB LT000125771-Amino-4-bromo-2-methylanthraquinon1-Amino-4-bromo-2-methylanthraquinone,95%1-Amino-4-bromo-2-methylanthra-9,10-quinone1-amino-4-bromo-2-methyl-10-anthracenedione1-AMINO-4-BROMO-2-METHYLANTHRAQUINONE, 9 9%

1-AMINO-2-METHYL-4-BROMO-9,10-ANTHRAQUINONERefChem:429337DTXCID4048195201-355-681-50-51-amino-4-bromo-2-methylanthracene-9,10-dione1-amino-4-bromo-2-methyl-9,10-dihydroanthracene-9,10-dioneMFCD00001221

데이터베이스 식별자

CAS: 81-50-5
PubChem CID: 66480
DTXSID: DTXSID1058848
UNII: K495LUA00R
EC Number: 201-355-6
Nikkaji: J192.587C

물성

구조 계산 물성

XLogP: 3.8
극성 표면적: 60.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 19
형식 전하: 0
복잡도: 411

물리화학적 성질

녹는점: 245 °C · 245 °C (dec.)(lit.)
물리적 상태: solid
EPA: 9 · 9,10-Anthracenedione, 1-amino-4-bromo-2-methyl- (81-50-5)

화학적 성질

orange to red crystalline powder

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]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 3 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29147000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39

화학 및 산업

용도 및 제조

General Manufacturing Information9,10-Anthracenedione, 1-amino-4-bromo-2-methyl-: INACTIVE

응용 분야 · 1건

용도1-Amino-4-bromo-2-methylanthraquinone has been used in the synthesis of 4-substituted 1-amino-2-methylanthraquinone derivatives:1-amino-2-methyl-4-phenylaminoanthraquinone1-amino-2-methyl-4-(3-methylphenylamino)anthraquinone1-amino-2-methyl-4-(4-methylphenylamino)anthraquinone1-amino-2-methyl-4-(1-naphthylamino)anthraquinone