2,3-Dihydro-2,2-dimethyl-7-benzofuranol

HCID 15278CAS 1563-38-8

기본 정보

표준 SMILES
CC1(C)Cc2cccc(O)c2O1
InChIKey
WJGPNUBJBMCRQH-UHFFFAOYSA-N
분자식
C10H12O2
평균 분자량
164.2 g/mol
단동위원소 질량
164.08372962

개요

Carbofuran phenol is an odorless, white crystalline solid.

이름 및 식별자

우선 이름
2,3-Dihydro-2,2-dimethyl-7-benzofuranol
IUPAC
2,2-dimethyl-3H-1-benzofuran-7-ol
영어명
2,3-Dihydro-2,2-dimethyl-7-benzofuranol
분자식
C10H12O2
분자량
164.2

이름 및 동의어

1563-38-82,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOLCarbofuran phenol7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-Carbofuran 7-phenolCarbofuranphenol2,3-Dihydro-2,2-dimethylbenzofuran-7-olNIA 10272CCRIS 9206HSDB 5839EINECS 216-350-42,2-Dimethyl-2,3-dihydrobenzo[b]furan-7-ol
이름 더 보기
2,3-dihydro-2,2-dimethyl-3,7-benzofurandiol7-Phenolnia10272FurafenolChebi:38474BenzofurabolCarbofuran 7-p
2,3-Dihydro-2,2-dimethyl-7-hydorxybenzofuranDTXSID2027414AI3-27488772HS1899GDTXCID4074142,2-DIMETHYL-2,3-DIHYDROBENZO(B)FURAN-7-OL2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOL [HSDB]Carbofuran 7phenol

데이터베이스 식별자

CAS
1563-38-8
PubChem CID
15278
DTXSID
DTXSID2027414
ChEMBL
CHEMBL2259976
ChEBI
CHEBI:38474
UNII
772HS1899G
EC Number
216-350-4
Nikkaji
J7.515I

물성

구조 계산 물성

XLogP
2.1
극성 표면적
29.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
12

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Benzofuran Derivatives
Pesticides · 2건

Environmental transformation -> Pesticide transformation products (metabolite, successor)

Pesticide degradation product

Vapor Pressure0.00000002 [mmHg]
Physical Description · 2건

Carbofuran phenol is an odorless, white crystalline solid.

White odorless solid; [CAMEO]

물리화학적 성질

끓는 점
95 °C · 95°C 1mm
밀도
1.101 g/mL · 1.101 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.541(lit.)
인화점
230 °F · >230 °F
저장 조건
2 · 2-8°C
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)

화학적 성질

Colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Hazard Traits - Hazard Trait Undefined

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelClass 9
Fire HazardsExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
Health HazardsExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
Hazards SummaryAn irritant; [MSDSonline]
Reactive GroupEthers

안전 및 보호

Fire FightingExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
First AidExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
Nonfire Spill ResponseExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
Isolation and EvacuationExcerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]:

독성 정보

Sediment/Soil ConcentrationsSOIL ANALYSES SHOWED THAT RESIDUES OF CARBOFURAN OR ITS METABOLITES, INCLUDING CARBOFURAN PHENOL, DISAPPEARED RAPIDLY AFTER APPLICATION AS GRANULES OR AS SEED TREATMENT, DROPPING TO ABOUT 0.12 PPM & 0.5 PPM, RESPECTIVELY, AFTER 44 DAYS.
Non-Human Toxicity ExcerptsOXYGEN UPTAKE, PRODUCT FORMATION, & PHOTON EMISSION IN THE INDOLE-3-ACETIC ACID/PEROXIDASE SYSTEM WERE INHIBITED BY CARBOFURAN PHENOL. THIS CARBOFURAN METABOLITE ACTED AS A COMPETITIVE INHIBITOR & WAS CONCOMITANTLY DEGRADED.
Toxicity DataLC50 (rat) > 18 ppm/6h
USGS Health-Based Screening Levels for Evaluating Water-Quality · 3건

7-Hydroxycarbofuran

Pesticide degradation product

Smith, C.D. and Nowell, L.H., 2024. Health-Based Screening Levels for evaluating water-quality data (3rd ed.). DOI:10.5066/F71C1TWP

규제 정보

FIFRA Requirements · 2건

RESIDUE TOLERANCES OF CARBOFURAN (2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL-N-METHYLCARBAMATE), ITS CARBAMATE & PHENOLIC METABOLITES, INCLUDING 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOL, ARE GIVEN FOR CUCUMBERS 0.4 PPM, MELONS 0.4 PPM, PUMPKINS 0.8 PPM, & SQUASH 0.8 PPM.

RESIDUE TOLERANCES OF CARBOFURAN (2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL-N-METHYLCARBAMATE), ITS CARBAMATE & PHENOLIC METABOLITES, INCLUDING 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANOL, ARE GIVEN FOR FRESH CORN 1.0 PPM.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
DF7708985
ridadr
UN 3082 9 / PGIII
HS 번호
2932990090
risk_code
36/37/38

화학 및 산업

약리 정보

Metabolism/Metabolites · 3건

ALFALFA CONTAINING CARBOFURAN RESIDUES WAS ADMIN TO A COW. THESE RESIDUES WERE METABOLIZED AND EXCRETED AS SULFATES OF 3-KETO-7-PHENOL (65%), THE 7-PHENOL (9.4%) AND THE 3,7-DIOL (6.4%).

(14)C-CARBOFURAN WAS APPLIED TO SOLN IN WHICH THE ROOTS OF 3-4 YEAR OLD MUGHO PINE WERE IMMERSED. ... IN ADDN TO TWO UNIDENTIFIED COMPD, CARBOFURAN PHENOL AND LESSER AMOUNTS OF 3-HYDROXYFURAN AND 3-KETOCARBOFURAN PHENOL WERE PRESENT.

RATS WITH THEIR BILE DUCTS CANNULATED WERE GIVEN AN ORAL DOSE OF RING-LABELED CARBOFURAN; WITHIN 48 HR THEY HAD EXCRETED 28.5% OF THE DOSE IN THEIR BILE, 65.4% IN THEIR URINE, AND 0.4% IN THEIR FECES. ...THE RELEASED COMPD...INCLUDED...CARBOFURAN PHENOL...

용도 및 제조

Use Classification · 2건

Environmental transformation -> Pesticide transformation products (metabolite, successor)

Transformation products

General Manufacturing Information7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-: ACTIVE

응용 분야

용도2,3-Dihydro-2,2-dimethyl-7-benzofuranol was used as starting reagent in the preparation of aminoalkanol derivatives of 2,3-dihydro-2,2-dimethyl-7-benzofuranol.

일반 설명Odorless, white crystalline solid.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

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