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1263287-70-2 | 1-Propen-1-amine, N,N-diethyl-3-(methylthio)-
CAS No: 1263287-70-2 Catalog No: AG000SN4 MDL No:
Product Description
Catalog Number:
AG000SN4
Chemical Name:
1-Propen-1-amine, N,N-diethyl-3-(methylthio)-
CAS Number:
1263287-70-2
Molecular Formula:
C8H17NS
Molecular Weight:
159.2923
IUPAC Name:
(E)-N,N-diethyl-3-methylsulfanylprop-1-en-1-amine
InChI:
InChI=1S/C8H17NS/c1-4-9(5-2)7-6-8-10-3/h6-7H,4-5,8H2,1-3H3/b7-6+
InChI Key:
KBAORPXMGKEUDV-VOTSOKGWSA-N
SMILES:
CSCC=CN(CC)CC
Properties
Complexity:
87.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
159.108g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.291g/mol
Monoisotopic Mass:
159.108g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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