2- (1,3-Dioxolan-2-yl) acetaldehyde

CAT: 0127-OR1066090Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1066090Size:10 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

90711-96-9

MDL Number

MFCD11505973

Purity

96%

Smiles

O=CCC1OCCO1

Chemical Information

2-(1,3-Dioxolan-2-yl)acetaldehyde

CAS Number	90711-96-9
PubChem CID	14359030
IUPAC Name	2-(1,3-dioxolan-2-yl)acetaldehyde
Molecular Formula	C5H8O3
Molecular Weight	116.11
XLogP	-0.7
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	8
Formal Charge	0
Complexity	75

SMILES

C1COC(O1)CC=O

InChI

InChI=1S/C5H8O3/c6-2-1-5-7-3-4-8-5/h2,5H,1,3-4H2

InChIKey

ZOTGJAVQDFWABL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 90711-96-9

CID: 14359030

Formula: C5H8O3

MW: 116.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	116.11
XLogP3	-0.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	116.047344113
Monoisotopic Mass	116.047344113
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	75.7
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

Catalog	Name
OR1074984-01	(1,3-Dioxolan-2-yl) methanamine
OR1065991-01	(1,3-Dioxolan-2-yl) acetonitrile
OR1099759-01	2- (1,3-Dioxolan-2-yl) pyridine
OR1043120-01	2- (1,3-Dioxolan-2-yl) ethanamine
OR40804-01	2- (1,3-Dioxolan-2-yl) aniline
OR919261-01	2- (1,3-Dioxolan-2-yl) furan
OR924361	2- (1,3-Dioxolan-2-yl) thiazole
PC1018660-01	3- (1,3-dioxolan-2-yl) -2-fluorobenzaldehyde
PC1016881-01	3- (1,3-dioxolan-2-yl) -2-fluoropyridine
OR1091489-01	3- (1,3-dioxolan-2-yl) -2-methoxypyridine

Catalog	Name
sc-337578	Benzyloxy- (2,2-dimethyl-[1,3]dioxolan-4-yl) -acetaldehyde
HBA23344-01	2-[ (4S) -2,2-Dimethyl-1,3-dioxolan-4-yl]acetaldehyde
159240	2- (Tetrahydrofuran-3-yl) acetaldehyde
JH917295	2- (OXETAN-3-YL) ACETALDEHYDE
FT151076-01	(2,2,3-Trimethylcyclopent-3-en-1-yl) acetaldehyde
GGA94155-01	2- (2-Methoxynaphthalen-1-yl) acetaldehyde
159239	2- (Tetrahydrofuran-3-yl) acetaldehyde discontinued
AR-T03138-01	2- (1H-indol-3-yl) acetaldehyde
PAD25422-01	2-Methoxy-2- (oxolan-3-yl) acetaldehyde
sc-479214A	(2-Oxo-1,3-benzoxazol-3 (2H) -yl) acetaldehyde