2,3,3-트리메칠-1-부탄

2,3,3-Trimethylbut-1-ene

HCID 11669
노트반응
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기본 정보

CAS
594-56-9
표준 SMILES
C=C(C)C(C)(C)C
InChIKey
AUYRUAVCWOAHQN-UHFFFAOYSA-N
분자식
C7H14
평균 분자량
98.19 g/mol
단동위원소 질량
98.10955045

이름 및 식별자

우선 이름
2,3,3-Trimethylbut-1-ene
IUPAC
2,3,3-trimethylbut-1-ene
현지명
2,3,3-트리메칠-1-부탄
영어명
2,3,3-TRIMETHYL-1-BUTENE
분자식
C7H14
분자량
98.19

이름 및 동의어

2,3,3-TRIMETHYL-1-BUTENE594-56-92,3,3-Trimethylbut-1-ene1-Butene, 2,3,3-trimethyl-EINECS 209-845-1DTXSID80208123NSC 73922RefChem:441596DTXCID00130614209-845-1InChI=1/C7H14/c1-6(2)7(3,4)5/h1H2,2-5HMFCD00008850
이름 더 보기
2,3,3-트리메칠-1-부탄2,3,3-트리메칠-1-부텐2,3,3-트리메틸-1-부텐2,3,3-트라이메틸-1-뷰텐TripteneTrimethylbutene2,2,3-trimethylbut-1-ene2,3,3-trimethyl-but-1-ene2,3,3-Trimethyl-1-butene >2,3,3-Trimethyl-1-butene 98%1-tert-butyl-1-methylethylene
NSC739222,3-Trimethyl-1-butene1-Butene,3,3-trimethyl-SCHEMBL515192SCHEMBL515193SCHEMBL4828330SCHEMBL9424611(CH3)3CC(CH3)=CH2

데이터베이스 식별자

CAS
594-56-9
PubChem CID
11669
DTXSID
DTXSID80208123
EC Number
209-845-1
Nikkaji
J96.153A

물성

구조 계산 물성

XLogP
3.4
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
1
무거운 원자 수
7

실험 및 물리화학적 성질

Kovats Retention Index · 2건

636.2；627；633.3；631.65；638；640；643；639.1；641.4；634；634；632；630；631；633；632；634；637；636；636

626；626；628.6；630.9；632；628；631；629；626；629；631；633；621；627.1；630

물리화학적 성질

녹는점
-109.85 °C · -109.85°C
끓는 점
78 · 78-80 °C(lit.)
밀도
0.705 g/mL · 0.705 g/mL at 25 °C(lit.)
증기 밀도
3.39 · 3.39 (vs air)
증기압
190 mm · 190 mm Hg ( 37.7 °C)
굴절률
20 · n20/D 1.402(lit.)

화학적 성질

CLEAR COLOURLESS LIQUID

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H315 (97.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 41 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.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (100%)；Skin Irrit. 2 (97.6%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.6%)

안전 데이터

wgk
3
ridadr
UN 3295 3/PG 2
HS 번호
29012900
risk_code
11-36/37/38
hazard_code
F,Xi
safety_code
16-26-36/37/39

화학 및 산업

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