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Acetaldehyde

CAT: 0572-TRC-A132600-100GSize: 100 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-A132600-100GSize:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
75-07-0
Synonyms
Acetic aldehyde; Ethanal; Ethyl aldehyde; NSC 7594
Hazard Statement
Extremely flammable liquid and vapour; UN number: UN1089; Packing Group: I
Smiles
CC=O
Molecular Formula
C2 H4 O
Molecular Weight
44.05
InChI
InChI=1S/C2H4O/c1-2-3/h2H,1H3
Additionnal Information
IUPAC name: acetaldehyde
Shipping Conditions
Ice Packs
Storage Conditions
+4°C

Chemical Information

Acetaldehyde

Acetaldehyde can cause cancer according to an independent committee of scientific and health experts.

CAS Number75-07-0
PubChem CID177
IUPAC Nameacetaldehyde
Molecular FormulaC2H4O
Molecular Weight44.05
XLogP-0.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count3
Formal Charge0
Complexity10
SMILES
CC=O
InChI
InChI=1S/C2H4O/c1-2-3/h2H,1H3
InChIKey
IKHGUXGNUITLKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acetaldehyde
CAS: 75-07-0
CID: 177
Formula: C2H4O
MW: 44.05
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight44.05
XLogP3-0.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass44.026214747
Monoisotopic Mass44.026214747
Topological Polar Surface Area17.1 Ų
Heavy Atom Count3
Formal Charge0
Complexity10.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes