하이드록시(5-)-2-펜탄온

5-Hydroxy-2-pentanone

HCID 14066CAS 1071-73-4

기본 정보

표준 SMILES
CC(=O)CCCO
InChIKey
JSHPTIGHEWEXRW-UHFFFAOYSA-N
분자식
C5H10O2
평균 분자량
102.13 g/mol
단동위원소 질량
102.06807956

이름 및 식별자

우선 이름
5-Hydroxy-2-pentanone
IUPAC
5-hydroxypentan-2-one
현지명
하이드록시(5-)-2-펜탄온
영어명
3-Acetyl-1-propanol
분자식
C5H10O2
분자량
102.13

이름 및 동의어

1071-73-45-Hydroxy-2-pentanoneAcetopropyl alcoholDTXSID30147917RefChem:109017DTXCID9070408213-994-83-Acetyl-1-propanol5-Hydroxypentan-2-one3-Acetopropanol3-Acetylpropanol2-Pentanone, 5-hydroxy-
이름 더 보기
3-아세틸-1-프로판올하이드록시(5-)-2-펜탄온Hydroxypentanone-Acetopropanol-Acetylpropanol
gamma-Acetopropanol4-Oxo-1-pentanolPROPANOL, 3-ACETYL-MFCD000029615-hydroxy-pentan-2-onegamma-Acetylpropyl alcohol.gamma.-AcetopropanolNSC 19158

데이터베이스 식별자

CAS
1071-73-4
PubChem CID
14066
DTXSID
DTXSID30147917
ChEBI
CHEBI:195472
EC Number
213-994-8
Nikkaji
J35.474K

물성

구조 계산 물성

XLogP
-0.4
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
7

실험 및 물리화학적 성질

Physical DescriptionColorless liquid; [Sigma-Aldrich MSDS]
Kovats Retention Index687

물리화학적 성질

녹는점
2.5 °C · 2.5°C (estimate)
끓는 점
144 · 144-145 °C/100 mmHg (lit.)
밀도
1.007 g/mL · 1.007 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.437(lit.)
인화점
200 °F · 200 °F
저장 조건
2 · 2-8°C

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 97.3% (72 of 74) of all reports.

Not Classified;Reported as not meeting GHS hazard criteria by 72 of 74 companies (only 2.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 74 reports by companies from 2 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 72 of 74 reports by companies.;There is 1 notification provided by 2 of 74 reports by companies with hazard statement code(s).;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

Hazards Summary · 1건

Causes diffuse hepatitis and somnolence in oral lethal-dose studies of mice; Causes abnormal liver function tests, changes in recordings from peripheral motor nerve, weight loss, degenerative changes to brain, and optic nerve neuropathy in repeated-dose inhalation studies of rats; [RTECS] May cause irritation; [Sigma-Aldrich MSDS] See Diacetone alcohol.

Hazard Classes and CategoriesNot Classified

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome;Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Toxicity DataLC (rat) > 2,000 mg/m3/4hr

안전 데이터

wgk
2
rtecs
UA4600000
독성
LD50 orl-rat: 6400 mg/k TNICS* 13,118,73
HS 번호
29144000
risk_code
36/37/38
hazard_code
Xi

화학 및 산업

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

관련 반응

22건

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