4-Chloro-1,3-dioxolan-2-one

CAT: 0926-FC36825-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0926-FC36825-01Size:25 g

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CAS Number

3967-54-2

MDL Number

MFCD00005383

Smiles

C1C (OC (=O) O1) Cl

Molecular Formula

C3H3ClO3

Molecular Weight

122.51 g/mol

Controlled

Chemical Information

4-Chloro-1,3-dioxolan-2-one

CAS Number	3967-54-2
PubChem CID	98075
IUPAC Name	4-chloro-1,3-dioxolan-2-one
Molecular Formula	C3H3ClO3
Molecular Weight	122.51
XLogP	-0.1
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	92

SMILES

C1C(OC(=O)O1)Cl

InChI

InChI=1S/C3H3ClO3/c4-2-1-6-3(5)7-2/h2H,1H2

InChIKey

OYOKPDLAMOMTEE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3967-54-2

CID: 98075

Formula: C3H3ClO3

MW: 122.51

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	122.51
XLogP3	-0.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	121.9770716
Monoisotopic Mass	121.9770716
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	92.2
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
IC181300-01	4-Chloro-4-methyl-5-methylene-1,3-dioxolan-2-one
FH35400-01	4- (Hydroxymethyl) -1,3-dioxolan-2-one
EAA42792-01	4-Phenyl-1,3-dioxolan-2-one
FC145402-01	4- (Chloromethyl) -1,3-dioxolan-2-one
YGC02541-01	4-Chloro-2- (1,3-dioxolan-2-yl) -1,3-thiazole
EAA42379-01	2,2-Pentamethylene-1,3-dioxolan-4-one
ETD20983-01	4- (Aminomethyl) -1,3-dioxolan-2-one hydrochloride
WGA73081	4,5-Difluoro-1,3-dioxolan-2-one
FM60273-01	(R) - (+) -4- (Methoxymethyl) -1,3-dioxolan-2-one
WMB07899-01	1-Chloro-3- (1,3-dioxolan-2-yl) -1,1-difluoropropan-2-one

Catalog	Name
269295-01	4-Chloro-1,3-dioxolan-2-one
PC99160	4-Chloro-5-trifluoromethyl-1,3-dioxolan-2-one
AR-O01242-01	4-chloro-4-methyl-5-methylene-1,3-dioxolan-2-one
TRC-C419135-2.5G	4-Chloro-4-(chloromethyl)-5-methylene-1,3-dioxolan-2-one
PC1019744-01	4-chloro-2- (1,3-dioxolan-2-yl) -3-fluorobenzaldehyde
OR1090667-01	4-chloro-3- (1,3-dioxolan-2-yl) -2-methoxybenzaldehyde
PC1019775-01	2-chloro-3- (1,3-dioxolan-2-yl) -4-fluorobenzaldehyde
PC1019706-01	2-chloro-3- (1,3-dioxolan-2-yl) -4-fluoropyridine
OR1101209	2-Chloro-3- (1,3-dioxolan-2-yl) -4-iodopyridine
291967-01	4-Vinyl-1,3-dioxolan-2-one