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1516-34-3 | Thiourea, N-pentyl-
CAS No: 1516-34-3 Catalog No: AG001NFP MDL No:
Product Description
Catalog Number:
AG001NFP
Chemical Name:
Thiourea, N-pentyl-
CAS Number:
1516-34-3
Molecular Formula:
C6H14N2S
Molecular Weight:
146.2538
IUPAC Name:
pentylthiourea
InChI:
InChI=1S/C6H14N2S/c1-2-3-4-5-8-6(7)9/h2-5H2,1H3,(H3,7,8,9)
InChI Key:
KIYXXKTUEPCNLC-UHFFFAOYSA-N
SMILES:
CCCCCNC(=S)N
Properties
Complexity:
83.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.088g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
146.252g/mol
Monoisotopic Mass:
146.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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