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869942-29-0

869942-29-0 | N-[(3-METHYL-2-THIENYL)METHYL]-2-BUTANAMINE

CAS No: 869942-29-0 Catalog No: AG004KEG MDL No:MFCD04578645

Product Description

Catalog Number:
AG004KEG
Chemical Name:
N-[(3-METHYL-2-THIENYL)METHYL]-2-BUTANAMINE
CAS Number:
869942-29-0
Molecular Formula:
C10H17NS
Molecular Weight:
183.3137
MDL Number:
MFCD04578645
IUPAC Name:
N-[(3-methylthiophen-2-yl)methyl]butan-2-amine
InChI:
InChI=1S/C10H17NS/c1-4-9(3)11-7-10-8(2)5-6-12-10/h5-6,9,11H,4,7H2,1-3H3
InChI Key:
NUDFKGPGTCEWRP-UHFFFAOYSA-N
SMILES:
CCC(NCc1sccc1C)C

Properties

Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.108g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.313g/mol
Monoisotopic Mass:
183.108g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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