1,3,3-Trimethoxypropene

CAT: 0926-FT32452-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-FT32452-01Size:0.5 g

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CAS Number

17576-35-1

MDL Number

MFCD00041903

Smiles

CO/C=C/C (OC) OC

Molecular Formula

C6H12O3

Molecular Weight

132.16 g/mol

Controlled

Chemical Information

1-Propene, 1,3,3-trimethoxy-

CAS Number	17576-35-1
PubChem CID	86587
IUPAC Name	1,3,3-trimethoxyprop-1-ene
Molecular Formula	C6H12O3
Molecular Weight	132.16
XLogP	0.3
Topological Polar Surface Area	27.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	9
Formal Charge	0
Complexity	76

SMILES

COC=CC(OC)OC

InChI

InChI=1S/C6H12O3/c1-7-5-4-6(8-2)9-3/h4-6H,1-3H3

InChIKey

JGVSIZVWGGQMPY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17576-35-1

CID: 86587

Formula: C6H12O3

MW: 132.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	132.16
XLogP3	0.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	132.078644241
Monoisotopic Mass	132.078644241
Topological Polar Surface Area	27.7 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	76.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	1
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
FT172317-01	1,1,3-Trimethoxypropane
FH158410-01	1,1,1,3,3,3-Hexabromoacetone
FB75602	1,3-Bis (3,3,3-trifluoropropyl) -1,1,3,3-tetramethyldisilazane
DBA78192	1,1,3,3-Tetramethyl propane-1,1,3,3-tetracarboxylate
FHA00615-01	1,1,1,3,3-Pentamethyl-3-octyldisiloxane
BAA00000-01	1,1,3,3-Tetraethyl-1,3-dimethyldisiloxane
NGA40020-01	1-Bromopropane-1,1,3,3,3-d5
BAA11815-01	1,1,3,3-Tetramethyldisiloxane-1,3-diol
SAA88294	1,3-Diethyl-1,1,3,3-tetramethyldisilazane
FD06011-01	1,3-Dichloro-1,1,3,3-tetraisopropyldisiloxane

Catalog	Name
sc-507243	1,3,3-Trimethoxypropene
229111-01	1,3,3-Trimethoxypropene 98+% (GC)
OR1049906-01	3,3''''-Dibromo-1,1':3',1'':3'',1''':3''',1''''-quinquephenyl
sc-485231	1,3-Bis (3,3,3-trifluoropropyl) -1,1,3,3-tetramethyldisilazane
410457-01	1,1,1,3,3,3-Hexafluoroisopropylamine
sc-224852	1,1,1,3,3,3-Hexabromoacetone
278680-01	1,1,1,3,3,3-Hexamethyldisilazane
OR95327-01	1,1,1,3,3,3-Hexaphenyldisiloxane
OR1008996-01	1,1,1,3,3,3-Hexaethyldisiloxane
HY-W440303	1,1',3,3,3',3'-Hexamethylindotricarbocyanine (perchlorate)