Etomidate Impurity 40

CAT: 1299-RM-E201340-02Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RM-E201340-02Size:25 mg

Selected

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

Quick Request Actions

CAS Number

31502-34-8

Synonyms

(R) -N- (1-phenylethyl) formamide

Molecular Formula

C9H11NO

Molecular Weight

149.19

Target Alternative Name

Etomidate

Product Name Synonym

(R) -N- (1-phenylethyl) formamide

Chemical Information

Etomidate Impurity 40

CAS Number	31502-34-8
PubChem CID	6951745
IUPAC Name	N-[(1R)-1-phenylethyl]formamide
Molecular Formula	C9H11NO
Molecular Weight	149.19
XLogP	1.4
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	119

SMILES

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

InChI

InChI=1S/C9H11NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-8H,1H3,(H,10,11)/t8-/m1/s1

InChIKey

CDHCCWRMWKZBGE-MRVPVSSYSA-N

Chemical Structure

2D Structure

CAS: 31502-34-8

CID: 6951745

Formula: C9H11NO

MW: 149.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	149.19
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	149.084063974
Monoisotopic Mass	149.084063974
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	119
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