1,3-Dimethoxypropan-2-ol

CAT: 0127-OR911780-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR911780-01Size:25 g

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CAS Number

623-69-8

MDL Number

MFCD01076303

Purity

98%

Smiles

COCC(O)COC

Chemical Information

1,3-Dimethoxy-2-propanol

CAS Number	623-69-8
PubChem CID	12190
IUPAC Name	1,3-dimethoxypropan-2-ol
Molecular Formula	C5H12O3
Molecular Weight	120.15
XLogP	-0.7
Topological Polar Surface Area	38.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	8
Formal Charge	0
Complexity	40

SMILES

COCC(COC)O

InChI

InChI=1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3

InChIKey

ZESKRVSPQJVIMH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 623-69-8

CID: 12190

Formula: C5H12O3

MW: 120.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	120.15
XLogP3	-0.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	120.078644241
Monoisotopic Mass	120.078644241
Topological Polar Surface Area	38.7 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	40.9
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
OR1037682-01	1,1-Dimethoxypropan-2-ol
OR1021357	3- (Benzyloxy) -2,2-dimethoxypropan-1-ol
OR90896-01	1,3-Dimethoxypropan-2-one
OR75610-01	1,3-Dimethoxypropan-2-amine
OR96162-01	2,2-Dimethoxypropan-1-amine
OR1072643-01	3,3-Dimethoxypropan-1-amine
OR1055159-01	N, N-Dibenzyl-1,3-dimethoxypropan-2-amine
PC2878-01	1,3-Difluoropropan-2-ol
OR1076535-01	2,3-Tridecadien-1-ol
OR1009990-01	2,3-Dimercaptopropan-1-Ol

Catalog	Name
TRC-B428468-500MG	2,3-dimethoxypropan-1-ol
KKA55259-01	1,1,1-Trifluoro-3,3-dimethoxypropan-2-ol
MJC50222-01	3- (4-Chlorophenyl) -1,1-dimethoxypropan-2-ol
abx182842-01	1,3-Dimethoxypropan-2-one
QIA45388-01	1,3-Dimethoxypropan-2-yl methanesulfonate
PEA26115-01	1,3-Dimethoxypropan-2-amine hydrochloride
THC98146-01	2,3-Dimethoxypropan-1-amine hydrochloride
AR-R10662-01	2,2-Dimethoxypropan-1-amine
DDA53134-01	1- (1,3-Dimethoxypropan-2-yl) piperazine
UGD90266-01	(1,3-Dimethoxypropan-2-yl) hydrazine dihydrochloride