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13214-66-9

13214-66-9 | Benzenebutanamine

CAS No: 13214-66-9 Catalog No: AG0010AJ MDL No:MFCD00008231

Product Description

Catalog Number:
AG0010AJ
Chemical Name:
Benzenebutanamine
CAS Number:
13214-66-9
Molecular Formula:
C10H15N
Molecular Weight:
149.2328
MDL Number:
MFCD00008231
IUPAC Name:
4-phenylbutan-1-amine
InChI:
InChI=1S/C10H15N/c11-9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,11H2
InChI Key:
AGNFWIZBEATIAK-UHFFFAOYSA-N
SMILES:
NCCCCc1ccccc1
EC Number:
236-186-7

Properties

Complexity:
84.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.12g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.237g/mol
Monoisotopic Mass:
149.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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