3,3,3-Trifluoro-1-propanol (HCID 137512)

이름 및 식별자

우선 이름: 3,3,3-Trifluoro-1-propanol
IUPAC: 3,3,3-trifluoropropan-1-ol
현지명: 3,3,3-트리플루오로-1-프로파놀
영어명: 3,3,3-Trifluoro-1-propanol
분자식: C3H5F3O
분자량: 114.07

이름 및 동의어

3,3,3-Trifluoro-1-propanol3,3,3-Trifluoropropan-1-olDTXSID30870950RefChem:90728DTXCID00818627670-540-5HDBGBTNNPRCVND-UHFFFAOYSA-N2240-88-23,3,3-trifluoropropanol65530-60-1MFCD00190649SCHEMBL10127

이름 더 보기

3,3,3-트리플루오로-1-프로파놀uoropropan-1-oL3,3,3-TRIFLUOROPROPANOL-13,3,3-Trifluoropropanol-1-ol3,3,3-TRIFLUORO-1-PROPANOL(I)3,3,3-Trifluoropropan-1-ol97%3,3, 3-trifluoro-propano-1-ol

3,3,3-Trifluoro-propan-1-olCS-W011251AB04522EN300-702581-Propanol, 3,3,3-trifluoro-trifluoropropanolAMY6830FT-OH

데이터베이스 식별자

CAS: 2240-88-2、65530-60-1
PubChem CID: 137512
DTXSID: DTXSID30870950
ChEMBL: CHEMBL4515005
EC Number: 613-814-1、670-540-5
Nikkaji: J1.053.223J

물성

구조 계산 물성

XLogP: 0.4
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 7
형식 전하: 0
복잡도: 48.6

실험 및 물리화학적 성질

PFAS · 4건

PFAS -> F-telomer alcohols (FTOH)

PFAS -> Non polymer polymers

PFAS -> Intentionally added food contact chemicals

PFAS -> Other/unspecified

SpringerMaterials PropertiesSchoenflies notation

LogP0.39

물리화학적 성질

끓는 점: 100 °C · 100 °C
밀도: 1 · 1,294 g/cm3
굴절률: 1.32 · 1.32
인화점: 37 °C · 37°C
저장 조건: 2 · 2-8°C
물리적 상태: 투명한 액체
산도 계수 (pKa): 14.09 · 14.09±0.10(Predicted)
색상: 무색 내지 거의 무색
Specific Gravity: 1.294 · 1.294
수용성: 물에 완전히 섞임.
BRN: 1734777 · 1734777
InChI: InChI=1S/C3H5F3O/c4-3(5,6)1-2-7/h7H,1-2H2
InChIKey: HDBGBTNNPRCVND-UHFFFAOYSA-N
SMILES: C(O)CC(F)(F)F
EPA: 3 · 3,3,3-Trifluoropropan-1-ol (2240-88-2)

화학적 성질

Clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H226 (23.5%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, 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 51 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationPoly(difluoromethylene), .alpha.-fluoro-.omega.-(2-hydroxyethyl)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesFlam. Liq. 3 (23.5%)

안전 데이터

wgk: WGK 3
ridadr: 1987
HS 번호: 29055900
risk_code: 20/21/22-36/37/38-36-25-10
hazard_code: F,T
safety_code: 26-36/37/39-45-37
포장분류: III
위험 등급: 3
위험 참고 사항: Flammable
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

용도 및 제조

Uses• Surface active agent in oil and gas drilling, extraction, and support activities [Ref: https://www.epa.gov/chemical-data-reporting/2016-chemical-data-reporting-results]

Use ClassificationPFAS -> F-telomer alcohols (FTOH)