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892592-86-8 | N-(3-THIENYLMETHYL)-2-BUTANAMINE
CAS No: 892592-86-8 Catalog No: AG0041Z0 MDL No:MFCD07411606
Product Description
Catalog Number:
AG0041Z0
Chemical Name:
N-(3-THIENYLMETHYL)-2-BUTANAMINE
CAS Number:
892592-86-8
Molecular Formula:
C9H15NS
Molecular Weight:
169.2871
MDL Number:
MFCD07411606
IUPAC Name:
N-(thiophen-3-ylmethyl)butan-2-amine
InChI:
InChI=1S/C9H15NS/c1-3-8(2)10-6-9-4-5-11-7-9/h4-5,7-8,10H,3,6H2,1-2H3
InChI Key:
PGSGIQWHDMIDHW-UHFFFAOYSA-N
SMILES:
CCC(NCc1cscc1)C
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.093g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.286g/mol
Monoisotopic Mass:
169.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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