N-Butyl 2-Hydroxyethanesulfonate

CAT: 1596-AR-P30697-01Size: 10 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-P30697-01Size:10 Units

Selected

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

Quick Request Actions

CAS Number

78303-74-9

Molecular Formula

C6H14O4S

Molecular Weight

182.23

API Name

Pentamidine

Chemical Information

Butyl 2-hydroxyethanesulfonate

CAS Number	78303-74-9
PubChem CID	12729682
IUPAC Name	butyl 2-hydroxyethanesulfonate
Molecular Formula	C6H14O4S
Molecular Weight	182.24
XLogP	0.2
Topological Polar Surface Area	72
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	11
Formal Charge	0
Complexity	168

SMILES

CCCCOS(=O)(=O)CCO

InChI

InChI=1S/C6H14O4S/c1-2-3-5-10-11(8,9)6-4-7/h7H,2-6H2,1H3

InChIKey

WFPLDLNWNBTXJY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 78303-74-9

CID: 12729682

Formula: C6H14O4S

MW: 182.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	182.24
XLogP3	0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	182.06128010
Monoisotopic Mass	182.06128010
Topological Polar Surface Area	72 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	168
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
AR-P01416-01	Methyl 2-hydroxyethanesulfonate
AR-P30698-01	Ethyl 2-Hydroxyethanesulfonate
AR-P30699-01	Isopropyl 2-Hydroxyethanesulfonate
AR-P02022-01	N-Butyl-2-piperidine Carboxylic Acid
AR-E02007-01	N-Butyl methanesulphonate
AR-T01040-01	N-Butyl Tadalafil
AR-M05022-01	N-Butyl Molnupiravir
AR-B01258-01	N-butyl Benzenesulfonate
AR-N08172-01	N-tert-Butyl-N-ethylnitrosamine
AR-G02351-01	N-n-Butyl-D-Glucamine

Catalog	Name
sc-355571	N-butyl-N- (sec-butyl) -2-chloroacetamide
sc-331033	N-{2-[2- (sec-Butyl) phenoxy]butyl}cyclohexanamine
458412-01	N-Butyl 2-bromobenzamide
QCA57020-01	N-Butyl-2-methoxyaniline
458413-01	N-Butyl 2-bromobenzenesulfonamide
PBA58121	N-Butyl-2-cyanoacetamide
UDA31873-01	N-Butyl-2-chloropropanamide
OR962548	N-Butyl-2-nitroaniline
OR1014306	N-Butyl 2-Methylbutyrate
sc-338254	N-Butyl 2,2-Difluorocyclopropanecarboxylate