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N,N-Dibenzylformamide

CAT: 0572-TRC-D417100-500MGSize: 500 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D417100-500MGSize:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5464-77-7
Synonyms
N,N-Bis(phenylmethyl)formamide; Dibenzylformamide; NSC 5982;
Hazard Statement
No Data Available
Smiles
O=CN(Cc1ccccc1)Cc2ccccc2
Molecular Formula
C15H15NO
Molecular Weight
225.29
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

n,n-Dibenzylformamide
CAS Number5464-77-7
PubChem CID221415
IUPAC NameN,N-dibenzylformamide
Molecular FormulaC15H15NO
Molecular Weight225.28
XLogP2.7
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count17
Formal Charge0
Complexity197
SMILES
C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C=O
InChI
InChI=1S/C15H15NO/c17-13-16(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15/h1-10,13H,11-12H2
InChIKey
OTHBCWKTCXJYAW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of n,n-Dibenzylformamide
CAS: 5464-77-7
CID: 221415
Formula: C15H15NO
MW: 225.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight225.28
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass225.115364102
Monoisotopic Mass225.115364102
Topological Polar Surface Area20.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity197
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

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