메틸9H-잔텐-9-카르복실레이트

methyl 9H-xanthene-9-carboxylate

HCID 699662

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 39497-06-8
표준 SMILES: COC(=O)C1c2ccccc2Oc2ccccc21
InChIKey: RFHABUQANXJNQS-UHFFFAOYSA-N
분자식: C15H12O3
평균 분자량: 240.25 g/mol
단동위원소 질량: 240.07864424

이름 및 식별자

우선 이름: methyl 9H-xanthene-9-carboxylate
IUPAC: methyl 9H-xanthene-9-carboxylate
현지명: 메틸9H-잔텐-9-카르복실레이트
영어명: Methyl 9H-xanthene-9-carboxylate
분자식: C15H12O3
분자량: 240.25

이름 및 동의어

methyl 9H-xanthene-9-carboxylate39497-06-8Methyl xanthanoatemethyl xanthene-9-carboxylateMFCD00100676Xanthene-9-carboxylic acid methyl ester9H-xanthene-9-carboxylic acid methyl esterMaybridge4_003227methyl 9-xanthenecarboxylateMethylxanthene-9-carboxylateOprea1_627505orb3144331

이름 더 보기

메틸9H-잔텐-9-카르복실레이트Methylxanthene-9-carboxylate,98%Xanthene-9-Carboxylic Methyl ester

SCHEMBL2596509DTXSID20351420RFHABUQANXJNQS-UHFFFAOYSA-NHMS1530C15CS-M2864SBB057848STK424586TYD-03672

데이터베이스 식별자

CAS: 39497-06-8
PubChem CID: 699662
DTXSID: DTXSID20351420
EC Number: 809-383-6
Nikkaji: J47.579C

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 18
형식 전하: 0
복잡도: 293

물리화학적 성질

끓는 점: 331.5 · 331.5±41.0 °C(Predicted)
밀도: 1.233 · 1.233±0.06 g/cm3(Predicted)

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]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 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.