CAS 70264-94-7 Methyl 4-(bromomethyl)-3-methoxybenzoate (HCID 2759828)

이름 및 식별자

우선 이름: Methyl 4-(bromomethyl)-3-methoxybenzoate
IUPAC: methyl 4-(bromomethyl)-3-methoxybenzoate
영어명: Methyl 4-(bromomethyl)-3-methoxybenzoate
분자식: C10H11BrO3
분자량: 259.1

이름 및 동의어

Methyl 4-(bromomethyl)-3-methoxybenzoate70264-94-7DTXSID70374927RefChem:157565DTXCID50325957615-092-33-methoxy-4-(bromomethyl)benzoic acid methyl esterMFCD00270115methyl 4-bromomethyl-3-methoxybenzoate4-bromomethyl-3-methoxy-benzoic acid methyl estermethyl 4-(bromomethyl)-3-methoxy-benzoate3-methoxy-4-bromomethylbenzoic acid methyl ester

이름 더 보기

METHYL 3-METHOXY-4-BROMOMETHYLBENZOATE)-3-methoxybenzoate4-(bromomethyl)-3-methoxybenzoateMETHYL4-BROMOETHYL-3-METHOXYBENZOATE4-bromethyl-3-methoxymethyl benzoateMETHYL3-METHOXY-4-(BROMOMETHYL)BENZONATEMethyl 4-(bromomethyl)-3-methoxybenzonateMethyl4-(Bromomethyl)-3-methoxybenzoate>

EC 410-310-1Methyl 4-(Bromomethyl)-m-anisatemethyl-4-bromomethyl-3-methoxybenzoateBG-0064methyl 3-methoxy-4-(bromomethyl)benzoateSY020356M23564-bromomethyl-3-methoxybenzoic acid methyl ester

데이터베이스 식별자

CAS: 70264-94-7
PubChem CID: 2759828
DTXSID: DTXSID70374927
EC Number: 410-310-1、615-092-3
Nikkaji: J3.381.775D

물성

구조 계산 물성

XLogP: 2.3
극성 표면적: 35.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 14
형식 전하: 0
복잡도: 196

물리화학적 성질

녹는점: 92 · 92-94°C
끓는 점: 324.2 · 324.2±32.0 °C(Predicted)
밀도: 1.432 · 1.432
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: 클로로포름(소량으로 용해), 메탄올(약간 용해됨)
물리적 상태: powder to crystal
색상: 흰색에서 밝은 노란색
InChI: InChI=1S/C10H11BrO3/c1-13-9-5-7(10(12)14-2)3-4-8(9)6-11/h3-5H,6H2,1-2H3
InChIKey: UXSNXOMMJXTFEG-UHFFFAOYSA-N
SMILES: C(OC)(=O)C1=CC=C(CBr)C(OC)=C1

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H315: Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

유해성 정보

Regulatory InformationStatus: No longer Valid Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/4128

Hazard Classes and Categories · 4건

Skin Irrit. 2 (100%)

Skin irritation - category 2

Skin Irrit. 2

안전 데이터

wgk: 3
ridadr: UN 2811 6.1/PG 3
HS 번호: 2918999090
risk_code: 36/37/38-50/53-43-41-38
hazard_code: Xi,N
safety_code: 26-36/37/39-61-60
포장분류: Ⅲ
위험 등급: IRRITANT
Hazard Classifications: Aquatic Acute 1Aquatic Chronic 1Eye Dam. 1Skin Irrit. 2Skin Sens. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects