Basic information
- CAS
17224-18-9- Standard SMILES
CCCCOc1ccc(C=Nc2ccc(C(C)=O)cc2)cc1- InChIKey
OCSNPDHAHJRADR-UHFFFAOYSA-N- Molecular formula
- C19H21NO2
- Average molar mass
- 295.4 g/mol
- Monoisotopic mass
- 295.15722891
Names & identifiers
- Preferred name
- 1-(4-(((4-Butoxyphenyl)methylene)amino)phenyl)ethanone
- IUPAC
- 1-[4-[(4-butoxyphenyl)methylideneamino]phenyl]ethanone
- English name
- 4'-n-Butoxybenzylidene-4-acetylaniline
- Molecular formula
- C19H21NO2
- Molecular weight
- 295.38
Names & synonyms
17224-18-91-(4-(((4-Butoxyphenyl)methylene)amino)phenyl)ethanone1-[4-[[(4-Butoxyphenyl)methylene]amino]phenyl]ethanoneRefChem:224658N-(4-Butoxybenzylidene)-4-acetylaniline4'-n-butoxybenzylidene-4-acetylaniline1-(4-((4-Butoxybenzylidene)amino)phenyl)ethan-1-one4-N-Butoxybenzylidene-4-acetylaniline1-[4-[(4-butoxyphenyl)methylideneamino]phenyl]ethanoneMFCD00059418Ethanone, 1-[4-[[(4-butoxyphenyl)methylene]amino]phenyl]-4'-(4-Butoxybenzylideneamino)acetophenone
Show more names
ButoxybenzylideneacetylanilineN-(4-Butoxybenzylidene)-4-acetylaniline >4''-N-BUTOXYBENZYLIDENE-4-ACETYLANILINE 99+%1-[4-(4-Butoxybenzylideneamino)phenyl]ethanone
AcPi4OPSCHEMBL3795096SCHEMBL12416684DTXSID60336418OCSNPDHAHJRADR-UHFFFAOYSA-NOCSNPDHAHJRADR-XSFVSMFZSA-NAKOS0049083121334230-73-7
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 350
Experimental & physicochemical properties
Chemical ClassesLiquid Crystal (LCM) Monomers
Physicochemical properties
- Melting point
- 120 °C · 120 °C
- Boiling point
- 459.4 · 459.4±30.0 °C(Predicted)
- Density
- 1.02 · 1.02±0.1 g/cm3(Predicted)
- solubility
- soluble in Methanol
- form
- powder to crystal
- pka
- 2.74 · 2.74±0.50(Predicted)
- color
- Light yellow to Yellow to Orange
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- HS Code
- 2925.29 · 2925.29.6000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2925.29.6000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Suppliers33 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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