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DABI

CAT: 0013-GTR19194849Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19194849Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
DABI (CAS 443-30-1) is a small molecule compound for life science research. It is utilized in biochemical studies and has been referenced in in vitro research investigating its interactions with biological targets.
CAS Number
443-30-1
Smiles
CN (C) c1ccc (C=C2C=Cc3ccccc23) cc1
Molecular Formula
C18H17N
Molecular Weight
247.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dabi

structure

CAS Number443-30-1
PubChem CID5351197
IUPAC Name4-[(Z)-inden-1-ylidenemethyl]-N,N-dimethylaniline
Molecular FormulaC18H17N
Molecular Weight247.3
XLogP4.4
Topological Polar Surface Area3.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity358
SMILES
CN(C)C1=CC=C(C=C1)/C=C\2/C=CC3=CC=CC=C32
InChI
InChI=1S/C18H17N/c1-19(2)17-11-7-14(8-12-17)13-16-10-9-15-5-3-4-6-18(15)16/h3-13H,1-2H3/b16-13-
InChIKey
HXVZHTQDVDNJMN-SSZFMOIBSA-N
Chemical Structure
2D Structure
2D structure of Dabi
CAS: 443-30-1
CID: 5351197
Formula: C18H17N
MW: 247.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.3
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass247.136099547
Monoisotopic Mass247.136099547
Topological Polar Surface Area3.2 Ų
Heavy Atom Count19
Formal Charge0
Complexity358
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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