(-) -Ibuprofenamide

CAT: 0926-WEA83978-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-WEA83978-02Size:10 mg

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

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CAS Number

121839-78-9

Smiles

CC (C) CC1=CC=C (C=C1) C (C) C (=O) N

Molecular Formula

C13H19NO

Molecular Weight

205.3 g/mol

Controlled

Chemical Information

(R)-Ibuprofenamide

CAS Number	121839-78-9
PubChem CID	715794
IUPAC Name	(2R)-2-[4-(2-methylpropyl)phenyl]propanamide
Molecular Formula	C13H19NO
Molecular Weight	205.30
XLogP	2.8
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	15
Formal Charge	0
Complexity	205

SMILES

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

InChI

InChI=1S/C13H19NO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H2,14,15)/t10-/m1/s1

InChIKey

REUQKCDCQVNKLW-SNVBAGLBSA-N

Chemical Structure

2D Structure

CAS: 121839-78-9

CID: 715794

Formula: C13H19NO

MW: 205.30

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	205.30
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	205.146664230
Monoisotopic Mass	205.146664230
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	205
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