Etomidate Impurity 35

CAT: 1596-AR-E10723-01Size: 10 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-E10723-01Size:10 Units

Selected

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

Quick Request Actions

CAS Number

194545-44-3

Molecular Formula

C8H10O2

Molecular Weight

138.17

API Name

Etomidate

Chemical Information

3-[(1S)-1-hydroxyethyl]phenol

CAS Number	194545-44-3
PubChem CID	40715758
IUPAC Name	3-[(1S)-1-hydroxyethyl]phenol
Molecular Formula	C8H10O2
Molecular Weight	138.16
XLogP	0.5
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	103

SMILES

C[C@@H](C1=CC(=CC=C1)O)O

InChI

InChI=1S/C8H10O2/c1-6(9)7-3-2-4-8(10)5-7/h2-6,9-10H,1H3/t6-/m0/s1

InChIKey

COJRWHSKVYUZHQ-LURJTMIESA-N

Chemical Structure

2D Structure

CAS: 194545-44-3

CID: 40715758

Formula: C8H10O2

MW: 138.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	138.16
XLogP3	0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	138.068079557
Monoisotopic Mass	138.068079557
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	103
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes