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Vanillylamine

CAT: 0013-GTR19252839-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19252839-01Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Vanillylamine
CAS Number
1196-92-5
Field of Research
Signal Transduction
Purity
99.56% (May vary between batches)
Smiles
COc1cc (CN) ccc1O
Molecular Formula
C8H11NO2
Molecular Weight
153.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Vanillylamine

Vanillylamine is an aralkylamino compound. It is functionally related to a vanillyl alcohol. It is a conjugate base of a vanillylamine(1+).

CAS Number1196-92-5
PubChem CID70966
IUPAC Name4-(aminomethyl)-2-methoxyphenol
Molecular FormulaC8H11NO2
Molecular Weight153.18
XLogP-0.2
Topological Polar Surface Area55.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity119
SMILES
COC1=C(C=CC(=C1)CN)O
InChI
InChI=1S/C8H11NO2/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,10H,5,9H2,1H3
InChIKey
WRPWWVNUCXQDQV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vanillylamine
CAS: 1196-92-5
CID: 70966
Formula: C8H11NO2
MW: 153.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight153.18
XLogP3-0.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass153.078978594
Monoisotopic Mass153.078978594
Topological Polar Surface Area55.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity119
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T65495-01Vanillylamine
HY-W015211-01Vanillylamine (hydrochloride)
sc-216052Vanillylamine Hydrochloride
AR-V06389-01Vanillylamine HCl
HY-W097899R-01Vanillylamine (Standard)
TRC-V097602-1MGVanillylamine-d3 Hydrochloride
HY-W097899S-01Vanillylamine-d3 (hydrochloride)
GK3424-5g2-Vanillylamine hydrochloride

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