Products for Research Use Only
RegisterLogin

Diphenhydramine Impurity 23

CAT: 1299-RM-D080823-01Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1299-RM-D080823-01Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
21945-86-8
Synonyms
N, N-dimethyl-2- (phenyl (m-tolyl) methoxy) ethan-1-amine
Molecular Formula
C18H23NO
Molecular Weight
269.39
Target Alternative Name
Diphenhydramine
Product Name Synonym
N, N-dimethyl-2- (phenyl (m-tolyl) methoxy) ethan-1-amine

Chemical Information

O-Demethyl-m-methyl orphenadrine
CAS Number21945-86-8
PubChem CID28656
IUPAC NameN,N-dimethyl-2-[(3-methylphenyl)-phenylmethoxy]ethanamine
Molecular FormulaC18H23NO
Molecular Weight269.4
XLogP3.6
Topological Polar Surface Area12.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity260
SMILES
CC1=CC(=CC=C1)C(C2=CC=CC=C2)OCCN(C)C
InChI
InChI=1S/C18H23NO/c1-15-8-7-11-17(14-15)18(20-13-12-19(2)3)16-9-5-4-6-10-16/h4-11,14,18H,12-13H2,1-3H3
InChIKey
VSIVTUKDXUYWPL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of O-Demethyl-m-methyl orphenadrine
CAS: 21945-86-8
CID: 28656
Formula: C18H23NO
MW: 269.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.4
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass269.177964357
Monoisotopic Mass269.177964357
Topological Polar Surface Area12.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity260
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
RM-D080817-01Diphenhydramine Impurity 17
RM-D080824-01Diphenhydramine Impurity 24
RM-D080812-01Diphenhydramine Impurity 12
RM-D080810-01Diphenhydramine Impurity 10
RM-D080815-01Diphenhydramine Impurity 15
RM-D080809-01Diphenhydramine Impurity 9
RM-D080811-01Diphenhydramine Impurity 11
RM-D080813-01Diphenhydramine Impurity 13
RM-D080819-01Diphenhydramine Impurity 19
RM-D080814-01Diphenhydramine Impurity 14

Alternative Products

CatalogName
AR-D07198-01Diphenhydramine Impurity 1
AR-D07202-01Diphenhydramine Impurity 6
AR-D07201-01Diphenhydramine Impurity 5
AR-D07199-01Diphenhydramine Impurity 3
AR-D01939-01Diphenhydramine Impurity K
AR-D07200-01Diphenhydramine Impurity 4
AR-D07205-01Diphenhydramine Impurity 8
KL-02-00977Diphenhydramine EP Impurity D
AR-D01950-01Diphenhydramine EP Impurity A HCl
AR-D01938-01Diphenhydramine EP Impurity C HCl

Popular Products