시클로헵틸시안화물

Cycloheptanecarbonitrile

HCID 96653CAS 32730-85-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: N#CC1CCCCCC1
InChIKey: UIZRDFICGGONJJ-UHFFFAOYSA-N
분자식: C8H13N
평균 분자량: 123.2 g/mol
단동위원소 질량: 123.10479942

이름 및 식별자

우선 이름: Cycloheptanecarbonitrile
IUPAC: cycloheptanecarbonitrile
현지명: 시클로헵틸시안화물
영어명: CYCLOHEPTYL CYANIDE
분자식: C8H13N
분자량: 123.2

이름 및 동의어

Cycloheptanecarbonitrile32730-85-1Cycloheptyl cyanideEINECS 251-180-4AI3-33238DTXSID50186404NSC 84183RefChem:129505DTXCID20108895251-180-4UIZRDFICGGONJJ-UHFFFAOYSA-NMFCD00004148

이름 더 보기

시클로헵틸시안화물CYANOCYCLOHEPTANETIMTEC-BB SBB008917Cycloheptane-1-carbonitrile

NSC84183cycloheptankohlenitrileCycloheptyl cyanide, 97%SCHEMBL59959SCHEMBL2533242SCHEMBL2538718SCHEMBL2539223SCHEMBL8075516

데이터베이스 식별자

CAS: 32730-85-1
PubChem CID: 96653
DTXSID: DTXSID50186404
EC Number: 251-180-4
Nikkaji: J275.840G

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 23.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 112

물리화학적 성질

끓는 점: 85 · 85-86 °C10 mm Hg(lit.)
밀도: 0.925 g/mL · 0.925 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.464(lit.)
인화점: 185 °F · 185 °F
저장 조건: Sealed in dry,Room Temperature

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 44 reports by companies from 4 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.