CAS 40817-08-1 4-Cyano-4'-pentylbiphenyl (HCID 92319)

이름 및 식별자

우선 이름: 4-Cyano-4'-pentylbiphenyl
IUPAC: 4-(4-pentylphenyl)benzonitrile
현지명: 4'-펜틸-4-바이페닐카르보나이트릴
영어명: 4-Cyano-4'-pentylbiphenyl
분자식: C18H19N
분자량: 249.35

이름 및 동의어

40817-08-14-Cyano-4'-pentylbiphenyl[1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl-p-Cyano-p'-pentylbiphenyl4-n-pentyl-4'-cyanobiphenyl2R6RYG3ZGM4'-Pentyl[1,1'-biphenyl]-4-carbonitrile(1,1'-Biphenyl)-4-carbonitrile, 4'-pentyl-DTXSID30682554'-Pentyl(1,1'-biphenyl)-4-carbonitrileRefChem:98646DTXCID4039817

이름 더 보기

4'-펜틸-4-바이페닐카르보나이트릴4'-펜틸-4-바이페닐카르보나이트릴(4'-PENTYL-4-BIPHENYLCARBONITRILE)5CBCB5RO-CM-51154-Cyano-4'-pentyLTIMTEC-BB SBB008542Amyl biphenyl nitrile4-AMYL-4'-CYANOBIPHENYL4-cyano-4-pentylbiphenyPentyl biphenyl nitrile

255-093-24'-Pentyl-[1,1'-biphenyl]-4-carbonitrile4-Cyano-4'-n-pentylbiphenyl4-(4-pentylphenyl)benzonitrile4'-Pentyl-4-biphenylcarbonitrile4-Pentyl-4'-cyanobiphenylMFCD000363504'-pentylbiphenyl-4-carbonitrile

데이터베이스 식별자

CAS: 40817-08-1
PubChem CID: 92319
DTXSID: DTXSID3068255
UNII: 2R6RYG3ZGM
EC Number: 255-093-2
Nikkaji: J21.996G

물성

구조 계산 물성

XLogP: 5.4
극성 표면적: 23.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 5
무거운 원자 수: 19
형식 전하: 0
복잡도: 284

물리화학적 성질

녹는점: 34 °C · 34 °C
끓는 점: 140 · 140-150 °C0.5 mm Hg(lit.)
밀도: 1.008 g/mL · 1.008 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.532(lit.)
인화점: 230 °F · >230 °F
저장 조건: Sealed in dry,Room Temperature
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 액정(네마틱)
색상: 회백색
수용성: 불용성
InChI: InChI=1S/C18H19N/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h6-13H,2-5H2,1H3
InChIKey: HHPCNRKYVYWYAU-UHFFFAOYSA-N
SMILES: C1(C2=CC=C(CCCCC)C=C2)=CC=C(C#N)C=C1
NIST: 1 · [1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl-(40817-08-1)
EPA: 1 · [1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl- (40817-08-1)

화학적 성질

white to light yellow crysta

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (83.6%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (83.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (74.5%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (16.4%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (74.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (83.6%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (74.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 55 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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

Regulatory InformationChemical: [1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl-

Hazard Classes and CategoriesAcute Tox. 4 (83.6%)；Acute Tox. 4 (83.6%)；Skin Irrit. 2 (74.5%)；Skin Sens. 1 (16.4%)；Eye Irrit. 2 (74.5%)；Acute Tox. 4 (83.6%)；STOT SE 3 (74.5%)

규제 정보

Regulatory InformationChemical: [1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl-

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: 3276
HS 번호: 29269090
risk_code: 20/21/22-36/37/38
hazard_code: Xn
safety_code: 23-26-28-36-36/37/39
포장분류: III
위험 등급: 6.1
기존화학 물질: KE-28071
Hazard Classifications: Skin Sens. 1
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing Information[1,1'-Biphenyl]-4-carbonitrile, 4'-pentyl-: ACTIVE

응용 분야

용도Intermediates of Liquid Crystals

일반 설명4′-Pentyl-4-biphenylcarbonitrile (5CB) is a nematic liquid crystal. 5CB undergoes phase transition from crystalline to nematic then to isotropic state at 18oC and 35oC respectively. It may be produced by modifying biphenyl.2

상·하류 제품 정보

상류 원료

마그네슘 아이오딘 암모니아(가스)N,N-다이메틸폼아마이드 4-Bromo-4'-n-pentylbiphenyl

공급사100 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shandong chuangyingchemical Co., Ltd.18853181302 · [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]

화합물 노트

불러오는 중…

4'-펜틸-4-바이페닐카르보나이트릴

기본 정보