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N-Benzylformamide

CAT: 0572-TRC-B276690-50GSize: 50 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-B276690-50GSize:50 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
6343-54-0
Synonyms
Benzylformamide; N-Formylbenzylamine; NSC 16247
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
O=CNCc1ccccc1
Molecular Formula
C8H9NO
Molecular Weight
135.17
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

N-Benzylformamide

N-benzylformamide is a member of formamides. It is functionally related to a formamide.

CAS Number6343-54-0
PubChem CID80654
IUPAC NameN-benzylformamide
Molecular FormulaC8H9NO
Molecular Weight135.16
XLogP1
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity97
SMILES
C1=CC=C(C=C1)CNC=O
InChI
InChI=1S/C8H9NO/c10-7-9-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,9,10)
InChIKey
IIBOGKHTXBPGEI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Benzylformamide
CAS: 6343-54-0
CID: 80654
Formula: C8H9NO
MW: 135.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight135.16
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass135.068413911
Monoisotopic Mass135.068413911
Topological Polar Surface Area29.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity97.4
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