Veratramide

CAT: 0926-FV70994-02Size: 2 gDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FV70994-02Size:2 g

Selected

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

Quick Request Actions

CAS Number

1521-41-1

Synonyms

3,4-Dimethoxybenzamide

MDL Number

MFCD00017128

Smiles

COC1=C (C=C (C=C1) C (=O) N) OC

Molecular Formula

C9H11NO3

Molecular Weight

181.19 g/mol

Controlled

Chemical Information

3,4-Dimethoxybenzamide

CAS Number	1521-41-1
PubChem CID	73705
IUPAC Name	3,4-dimethoxybenzamide
Molecular Formula	C9H11NO3
Molecular Weight	181.19
XLogP	1
Topological Polar Surface Area	61.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	184

SMILES

COC1=C(C=C(C=C1)C(=O)N)OC

InChI

InChI=1S/C9H11NO3/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H2,10,11)

InChIKey

XNDZRGTVUVVHQT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1521-41-1

CID: 73705

Formula: C9H11NO3

MW: 181.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.19
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	181.07389321
Monoisotopic Mass	181.07389321
Topological Polar Surface Area	61.6 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	184
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
FV28689-01	Veratramine