Ethyl 3-hydroxy-2,3-dimethylbutanoate

CAT: 0926-JBA84939-01Size: 50 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-JBA84939-01Size:50 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

34849-39-3

MDL Number

MFCD19686230

Smiles

CCOC (=O) C (C) C (C) (C) O

Molecular Formula

C8H16O3

Molecular Weight

160.21 g/mol

Controlled

Chemical Information

Ethyl 3-hydroxy-2,3-dimethylbutanoate

CAS Number	34849-39-3
PubChem CID	12603471
IUPAC Name	ethyl 3-hydroxy-2,3-dimethylbutanoate
Molecular Formula	C8H16O3
Molecular Weight	160.21
XLogP	0.9
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	11
Formal Charge	0
Complexity	140

SMILES

CCOC(=O)C(C)C(C)(C)O

InChI

InChI=1S/C8H16O3/c1-5-11-7(9)6(2)8(3,4)10/h6,10H,5H2,1-4H3

InChIKey

NXASSQYFJWHKMN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 34849-39-3

CID: 12603471

Formula: C8H16O3

MW: 160.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	160.21
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	160.109944368
Monoisotopic Mass	160.109944368
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	140
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
VAA20139-01	Ethyl 2-bromo-3,3-dimethylbutanoate
YDA55146-01	Ethyl 2-chloro-3,3-dimethylbutanoate
GJB29367-01	Methyl 2-hydroxy-2,3-dimethylbutanoate
AVD27341-01	Methyl 2-amino-3-hydroxy-2,3-dimethylbutanoate hydrochloride
UFA05474-01	(S) -Ethyl 2-amino-3,3-dimethylbutanoate hydrochloride
HEA97581-01	Sodium 4-hydroxy-2,2-dimethylbutanoate
FBA54029-01	Methyl 2,3-dimethylbutanoate
DXC60464-01	Propan-2-yl 4-hydroxy-2,2-dimethylbutanoate
RAA49540-01	Methyl 2-bromo-3,3-dimethylbutanoate
FCA71210	Methyl 2-cyano-3,3-dimethylbutanoate

Catalog	Name
OR26319	Ethyl 2,3-dimethylbutanoate
JH328394	Ethyl 3,3-dimethylbutanoate
OR1046865-01	Ethyl 2-amino-3,3-dimethylbutanoate hydrochloride
JH918963	Ethyl (S) -2-amino-3,3-dimethylbutanoate
OR1024784-01	Ethyl 2,2-Dimethylbutanoate
OR1007347-01	(s) -Ethyl 2-amino-3,3-dimethylbutanoate hydrochloride
PC5713	Ethyl 2-hydroxy-3,3,3-trifluoropropanoate
OR1093197-01	Ethyl 3-hydroxy-2,2,3-trimethylbutanoate
sc-279089	Ethyl 3-Hydroxy-2-naphthoate
OR1092808	Ethyl 2-hydroxy-3-methylbenzoate