Structure

4-Ethylaniline

CAS
589-16-2
Catalog Number
ACM589162
Category
Other Products
Molecular Weight
121.18
Molecular Formula
C8H11N

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Specification

IUPAC Name
4-ethylaniline
Canonical SMILES
CCC1=CC=C(C=C1)N
InChI
InChI=1S/C8H11N/c1-2-7-3-5-8(9)6-4-7/h3-6H,2,9H2,1H3
InChI Key
HRXZRAXKKNUKRF-UHFFFAOYSA-N
Boiling Point
214 °C
Melting Point
-5 °C
Density
Light Sensitive,Air Sensitive
Appearance
Colorless to Light orange to Yellow clear liquid
Storage
Store under inert gas
Complexity
72.6
Covalently-Bonded Unit Count
1
EC Number
209-637-0
Exact Mass
121.089149g/mol
Formal Charge
0
Hazard Statements
H311 : Toxic in contact with skin.H302 : Harmful if swallowed.H315 : Causes skin irritation.H319 : Causes serious eye irritation.H227 : Combustible liquid.
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
9
LogP
1.96 (LogP)
MDL Number
MFCD00007921
Monoisotopic Mass
121.089149g/mol
NSC Number
62015
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P270 : Do not eat, drink or smoke when using this product.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.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.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.P302 + P352 + P312 : IF ON SKIN: Wash with plenty of water.Call a POISON CENTER/doctor if you feel unwell.P403 + P235 : Store in a well-ventilated place. Keep cool.P405 : Store locked up.
Refractive Index
1.55
Rotatable Bond Count
1
Signal Word
Danger
Specific Gravity
0.97
UNII
MHX72W1ZQV
Vapor Pressure
0.14 mmHg
XLogP3
2
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