Structure

4-Butoxyaniline

CAS
4344-55-2
Catalog Number
ACM4344552
Category
Amines
Molecular Weight
165.24
Molecular Formula
C10H15NO

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Specification

Synonyms
4-Butoxyaniline, p-Butoxyaniline, p-Butyloxyaniline, Benzenamine, 4-butoxy-, 4-n-Butoxyaniline, ANILINE, p-BUTOXY-, Aminophenyl-n-butyl ether, p-Aminophenol n-butyl ether, 232343_ALDRICH, ARONIS023666, NSC 5443, EINECS 224-402-2, NSC5443, AIDS166526, AIDS-166526, BRN 2084421, SBB008295, ZINC01686943, FR-1184, LS-19627
IUPAC Name
4-butoxyaniline
Canonical SMILES
CCCCOC1=CC=C(C=C1)N
InChI
InChI=1S/C10H15NO/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7H,2-3,8,11H2,1H3
InChI Key
UBRIHZOFEJHMIT-UHFFFAOYSA-N
Boiling Point
157 °C/23 mmHg
Flash Point
113ºC
Density
Light Sensitive,Air Sensitive
Appearance
Colorless to Brown clear liquid
Storage
Store under inert gas
EC Number
224-402-2
Exact Mass
165.11500
Hazard Statements
H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.
H-Bond Acceptor
2
H-Bond Donor
1
MDL Number
MFCD00007866
Packing Group
III
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P270 : Do not eat, drink or smoke when using this product.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.
Refractive Index
1.54
RIDADR
NONH for all modes of transport
Safety Description
S26-S36/37/39-S45
Signal Word
Warning
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 4-butoxyaniline?

The molecular formula of 4-butoxyaniline is C10H15NO.

What is the molecular weight of 4-butoxyaniline?

The molecular weight of 4-butoxyaniline is 165.23 g/mol.

What is the IUPAC name of 4-butoxyaniline?

The IUPAC name of 4-butoxyaniline is 4-butoxyaniline.

What is the InChI of 4-butoxyaniline?

The InChI of 4-butoxyaniline is InChI=1S/C10H15NO/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7H,2-3,8,11H2,1H3.

What is the InChIKey of 4-butoxyaniline?

The InChIKey of 4-butoxyaniline is UBRIHZOFEJHMIT-UHFFFAOYSA-N.

What is the canonical SMILES of 4-butoxyaniline?

The canonical SMILES of 4-butoxyaniline is CCCCOC1=CC=C(C=C1)N.

What is the CAS number of 4-butoxyaniline?

The CAS number of 4-butoxyaniline is 4344-55-2.

What is the European Community (EC) number of 4-butoxyaniline?

The European Community (EC) number of 4-butoxyaniline is 224-402-2.

What is the ChEMBL ID of 4-butoxyaniline?

The ChEMBL ID of 4-butoxyaniline is CHEMBL3184190.

Is 4-butoxyaniline a canonicalized compound?

Yes, 4-butoxyaniline is a canonicalized compound.

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