α, β-Trehalose

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CAS Number

585-91-1

HS Code

2940009000

Stability

Stable under normal temperatures and pressures.

Molecular Formula

C12H22O11

Molecular Weight

342.3

Product Name Synonym

Antibiotic MC-916-A

Physical Properties

White crystalline powder

Safety Statements

S26-S36-S37

Density

1.768g/cm3

Flash Point

362.259oC

Melting Point

98-102oC

Chemical Information

alpha,beta-Trehalose

Alpha,beta-trehalose is a trehalose in which one of the glucose residues has alpha-configuration at the anomeric carbon, while the other has alpha-configuration. It is an alpha-D-glucoside, a beta-D-glucoside and a trehalose.

CAS Number	585-91-1
PubChem CID	10871590
IUPAC Name	(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-3,4,5-triol
Molecular Formula	C12H22O11
Molecular Weight	342.30
XLogP	-4.2
Topological Polar Surface Area	190
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	4
Heavy Atom Count	23
Formal Charge	0
Complexity	348

SMILES

C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)O

InChI

InChI=1S/C12H22O11/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12+/m1/s1

InChIKey

HDTRYLNUVZCQOY-BTLHAWITSA-N

Chemical Structure

2D Structure

CAS: 585-91-1

CID: 10871590

Formula: C12H22O11

MW: 342.30

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	342.30
XLogP3	-4.2
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	4
Exact Mass	342.11621151
Monoisotopic Mass	342.11621151
Topological Polar Surface Area	190 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	348
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
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
HY-W721582	β, β-Trehalose
sc-221192	α, β-Trehalose
74350211-25g	Trehalose
OR1036644	A, ß-Trehalose
MBS6048964-01	D(+)-Trehalose, Anhydrous (Mycose, a,a-Trehalose)
C53MR1045-50	Trehalose, TRE
OT175791-01	Trehalose hexaacetate
MT05879-01	Trehalose octaacetate
HY-N1132-01	D- (+) -Trehalose
AB0007	D-Trehalose

α, β-Trehalose

Chemical Information

Alternative Products

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