Products for Research Use Only
RegisterLogin

(1alpha,3alpha,5alpha)-3,5-dihydroxy-cyclohexanecarboxylic Acid Methyl Ester

CAT: 0572-TRC-D453100-5GSize: 5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-D453100-5GSize:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
156526-48-6
Hazard Statement
No Data Available
Smiles
COC(=O)[C@@H]1C[C@H](O)C[C@H](O)C1
Molecular Formula
C8 H14 O4
Molecular Weight
174.194
InChI
InChI=1S/C8H14O4/c1-12-8(11)5-2-6(9)4-7(10)3-5/h5-7,9-10H,2-4H2,1H3/t5-,6+,7-
Additionnal Information
IUPAC name: methyl (3S,5R)-3,5-dihydroxycyclohexane-1-carboxylate
Shipping Conditions
Room Temperature

Chemical Information

rac-methyl (1r,3R,5S)-3,5-dihydroxycyclohexane-1-carboxylate
CAS Number156526-48-6
PubChem CID11148017
IUPAC Namecis-methyl (3R,5S)-3,5-dihydroxycyclohexane-1-carboxylate
Molecular FormulaC8H14O4
Molecular Weight174.19
XLogP-0.3
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity158
SMILES
COC(=O)C1C[C@@H](C[C@@H](C1)O)O
InChI
InChI=1S/C8H14O4/c1-12-8(11)5-2-6(9)4-7(10)3-5/h5-7,9-10H,2-4H2,1H3/t5?,6-,7+
InChIKey
JKJAVWYVQRYVFS-DGUCWDHESA-N
Chemical Structure
2D Structure
2D structure of rac-methyl (1r,3R,5S)-3,5-dihydroxycyclohexane-1-carboxylate
CAS: 156526-48-6
CID: 11148017
Formula: C8H14O4
MW: 174.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight174.19
XLogP3-0.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass174.08920892
Monoisotopic Mass174.08920892
Topological Polar Surface Area66.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity158
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-D416075-250MG(1Alpha,3Alpha,5Alpha)-3,5-Diaminocyclohexanecarboxylic Acid
TRC-D416075-25MG(1Alpha,3Alpha,5Alpha)-3,5-Diaminocyclohexanecarboxylic Acid
TRC-M287920-10MG1alpha-Methyl-5alpha-androstan-3alpha,17Beta-diol
TRC-M287920-5MG1alpha-Methyl-5alpha-androstan-3alpha,17Beta-diol
TRC-M287922-25MG1alpha-Methyl-5alpha-androstan-3alpha,17beta-diol-d3
TRC-D454725-100MG3alpha,11beta-Dihydroxy-5alpha-pregnan-20-one
TRC-D455620-500MG3alpha,16alpha-Dihydroxy-5alpha-pregnan-20-one
TRC-K188550-50MG7-Keto-3alpha,12alpha-dihydroxy-5alpha-cholanic Acid
TRC-D452390-250MG3alpha,21-Dihydroxy-5alpha-pregnan-20-one
TRC-D488270-5MG3Alpha,4Beta-Dihydroxy-5Alpha-androstan-17-one

Alternative Products

CatalogName
sc-498878(1α,3α,5α) -3,5-dihydroxy-cyclohexanecarboxylic acid methyl ester
MBS6025562-01Cyclohexanecarboxylic Acid Methyl Ester
163234Cyclohexanecarboxylic Acid Methyl Ester-d11
OR1077025Cyclohexanecarboxylic acid, 4-methyl-, methyl ester
FD67717-013,5-Dihydroxy-4-methylbenzoic acid methyl ester
OR939191-013,4-Dihydroxy-5-methoxybenzoic acid methyl ester
JH9179794- (Acetylamino-methyl) -cyclohexanecarboxylic acid methyl ester
sc-3031431-Amino-cyclohexanecarboxylic acid methyl ester
OR951132-014-Oxo-cyclohexanecarboxylic acid methyl ester
PC520700-014- (Trifluoromethyl) cyclohexanecarboxylic acid methyl ester

Popular Products