Propionaldehyde

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CAS Number

123-38-6

Synonyms

Propionaldehyde; Propionaldehyde; Propanal; 123-38-6; Propanaldehyde; Propylaldehyde; Propaldehyde; Propional; Propionic Aldehyde

Molecular Formula

C3H6O

Molecular Weight

58.08

API Name

Miscellaneous

Chemical Information

Propanal

Propanal is an aldehyde that consists of ethane bearing a formyl substituent. The parent of the class of propanals. It has a role as an Escherichia coli metabolite. It is a member of propanals and an alpha-CH2-containing aldehyde.

CAS Number	123-38-6
PubChem CID	527
IUPAC Name	propanal
Molecular Formula	C3H6O
Molecular Weight	58.08
XLogP	0.6
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	4
Formal Charge	0
Complexity	17

SMILES

CCC=O

InChI

InChI=1S/C3H6O/c1-2-3-4/h3H,2H2,1H3

InChIKey

NBBJYMSMWIIQGU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 123-38-6

CID: 527

Formula: C3H6O

MW: 58.08

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	58.08
XLogP3	0.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	58.041864811
Monoisotopic Mass	58.041864811
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	4
Formal Charge	0
Complexity	17.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
TRC-P782500-10G	Propionaldehyde
GW7817-500mg	Propionaldehyde oxime
TRC-P782515-5G	Propionaldehyde (>80%)
GPC6948-D	Propionaldehyde 97%
abx085351	MPEG-Propionaldehyde
P782502	Propionaldehyde-d3
TRC-P827700-100G	Propionaldehyde Diethyl Acetal
TRC-T808956-2.5G	2-(Triphenylphosphoranylidene)propionaldehyde
sc-259398A	2- (Trifluoromethyl) propionaldehyde
sc-485413	Propionaldehyde Dimethyl Acetal

Propionaldehyde

Chemical Information

Alternative Products

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