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1000530-84-6 | 2-Thiophenepropanamine, 5-methyl-
CAS No: 1000530-84-6 Catalog No: AG0000PS MDL No:MFCD09912908
Product Description
Catalog Number:
AG0000PS
Chemical Name:
2-Thiophenepropanamine, 5-methyl-
CAS Number:
1000530-84-6
Molecular Formula:
C8H13NS
Molecular Weight:
155.2605
MDL Number:
MFCD09912908
IUPAC Name:
3-(5-methylthiophen-2-yl)propan-1-amine
InChI:
InChI=1S/C8H13NS/c1-7-4-5-8(10-7)3-2-6-9/h4-5H,2-3,6,9H2,1H3
InChI Key:
KXGJHODEJWQRRS-UHFFFAOYSA-N
SMILES:
Cc1ccc(s1)CCCN
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.077g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.259g/mol
Monoisotopic Mass:
155.077g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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