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Aldol Tech. Grade

CAT: 0286-A12910Size: 100 mgDry Ice: NoHazardous: Yes
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CAT#:0286-A12910Size:100 mg
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CAS Number
107-89-1
Synonyms
3-Hydroxybutanal
UN Code
UN2839
Pictogram
06 - Acute Toxicity; 07 - Irritant
UDF Signal Word
Danger
MDL Number
MFCD00024164
Hazard Statement
H302 Harmful if swallowed; H310 Fatal in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Aldol
DOT Classification
Class 6.1
Packaging Group
PGII
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P262 Do not get in eyes, on skin, or on clothing; P264 Wash skin thoroughly after handling; P270 Do not eat, drink, or smoke when using this product; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P350 IF ON SKIN: Gently wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; 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; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

3-Hydroxybutanal

Aldol appears as a clear white to yellow syrupy liquid. Denser than water. Contact may irritate skin and eyes. Moderately toxic by ingestion, inhalation and skin absorption.

CAS Number107-89-1
PubChem CID7897
IUPAC Name3-hydroxybutanal
Molecular FormulaC4H8O2
Molecular Weight88.11
XLogP-0.6
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count6
Formal Charge0
Complexity42
SMILES
CC(CC=O)O
InChI
InChI=1S/C4H8O2/c1-4(6)2-3-5/h3-4,6H,2H2,1H3
InChIKey
HSJKGGMUJITCBW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Hydroxybutanal
CAS: 107-89-1
CID: 7897
Formula: C4H8O2
MW: 88.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight88.11
XLogP3-0.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass88.052429494
Monoisotopic Mass88.052429494
Topological Polar Surface Area37.3 Ų
Heavy Atom Count6
Formal Charge0
Complexity42.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes