기본 정보
- 표준 SMILES
NCC1CCCO1- InChIKey
YNOGYQAEJGADFJ-UHFFFAOYSA-N- 분자식
- C5H11NO
- 평균 분자량
- 101.15 g/mol
- 단동위원소 질량
- 101.08406397
개요
Tetrahydrofurfurylamine appears as a colorless to light yellow liquid. Insoluble in water and less dense than water. Used to make other chemicals and as a photographic chemical.
이름 및 식별자
- 우선 이름
- Tetrahydrofurfurylamine
- IUPAC
- oxolan-2-ylmethanamine
- 현지명
- 2-테트라히드로푸르푸릴아민
- 영어명
- 2-Tetrahydrofurfurylamine
- 분자식
- C5H11NO
- 분자량
- 101.15
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
4795-29-3- PubChem CID
- 253298
- DTXSID
DTXSID40863454- EC Number
- 225-351-9
- Nikkaji
- J1.830I
물성
구조 계산 물성
- XLogP
- -0.3
- 극성 표면적
- 35.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 56
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 136 °C · 136 °C
- 끓는 점
- 153 · 153-154 °C744 mm Hg(lit.)
- 밀도
- 0.98 g/mL · 0.98 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.454(lit.)
- 인화점
- 114 °F · 114 °F
- 저장 조건
- Flammables area
- 용해도
- 클로로포름, 메탄올에 용해됨
- 산도 계수 (pKa)
- 9.47 · 9.47±0.29(Predicted)
- 물리적 상태
- 액체
- 색상
- 무색투명~연황색
- 폭발한계
- 1.6 · 1.6-14.1%(V)
- 수용성
- 혼용 가능
- BRN
- 102729 · 102729
- InChI
- 1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2
- InChIKey
- YNOGYQAEJGADFJ-UHFFFAOYSA-N
- SMILES
- NCC1CCCO1
- LogP
- -0.348 · -0.348 (est)
- NIST
- 2 · 2-Furanmethanamine, tetrahydro-(4795-29-3)
- EPA
- Tetrahydrofurfurylamine (4795-29-3)
화학적 성질
Colorless to light-yellow liquid. Distilling range 150– 156C, d 0.977 (20C/20C). Combustible.
안전 및 규제
GHS 분류
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 153 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Status: Active Update: 28-06-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19861
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.)
Fire Hazards
Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.
Health Hazards
Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
· May cause toxic effects if inhaled or absorbed through skin.
Reactivity Profile
TETRAHYDROFURFURYLAMINE is an amine and alcohol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
DOT Hazard Classification
Tetrahydrofurfurylamine
UN2943
Class 3 Flammable and combustible liquid (49 eCFR § 173.120)
PG III: the degree of danger presented by the material is minor
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable agents - 2nd degree
안전 및 보호
Accidental Release Measures
· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.
· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.
First Aid
Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Immediate precautionary measure
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- LV0175000
- ridadr
- UN 2943
- HS 번호
- 29321900
- risk_code
- 10-36/37/38
- hazard_code
- Xi
- safety_code
- 26-36-37/39-16
- 포장분류
- III
- 위험 등급
- 3
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
용도 및 제조
응용 분야
용도Chemical intermediate, fine-grain photographic development, vulcanization accelerator.
일반 설명A colorless to light yellow liquid. Insoluble in water and less dense than water. Flash point between 100 - 141°F. Used to make other chemicals and as a photographic chemical.
상·하류 제품 정보
하류 제품
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