3-아미노-2,6-자일레놀

3-Amino-2,6-dimethylphenol

HCID 81477CAS 6994-64-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1ccc(N)c(C)c1O
InChIKey: XSBKXUJEVYHSNO-UHFFFAOYSA-N
분자식: C8H11NO
평균 분자량: 137.18 g/mol
단동위원소 질량: 137.08406397

이름 및 식별자

우선 이름: 3-Amino-2,6-dimethylphenol
IUPAC: 3-amino-2,6-dimethylphenol
현지명: 3-아미노-2,6-자일레놀
영어명: 3-amino-2,6-xylenol
분자식: C8H11NO
분자량: 137.18

이름 및 동의어

3-amino-2,6-dimethylphenol6994-64-5UNII-KK52J0MQ7DEINECS 230-268-6KK52J0MQ7D2,6-dimethyl-3-aminophenolDTXSID80220224Phenol, 3-amino-2,6-dimethyl-2,6-XYLENOL, 3-AMINO-2,6-DIMETHYL-5-AMINOPHENOLRefChem:92865DTXCID80142715

이름 더 보기

3-아미노-2,6-자일레놀3-amino-2,6-dimethylphenol HCl

3-AMINO-2,6-DIMETHYLPHENOL [INCI]230-268-63-Amino-2,6-xylenolMFCD09971645SCHEMBL1262002,6-dimethyl-3-amino phenol3-amino 2,6-dimethyl phenol3-amino-2,6-dimethyl phenol

데이터베이스 식별자

CAS: 6994-64-5
PubChem CID: 81477
DTXSID: DTXSID80220224
UNII: KK52J0MQ7D
EC Number: 230-268-6
Nikkaji: J266.044J

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 46.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 116

물리화학적 성질

화장품 원료 기능: 머리 염색

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P264, P270, P301+P317, P319, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 37 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.