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101190-78-7 | Thiourea, N-[imino(pentylamino)methyl]-
CAS No: 101190-78-7 Catalog No: AG0003WY MDL No:
Product Description
Catalog Number:
AG0003WY
Chemical Name:
Thiourea, N-[imino(pentylamino)methyl]-
CAS Number:
101190-78-7
Molecular Formula:
C7H16N4S
Molecular Weight:
188.2937
IUPAC Name:
(N'-pentylcarbamimidoyl)thiourea
InChI:
InChI=1S/C7H16N4S/c1-2-3-4-5-10-6(8)11-7(9)12/h2-5H2,1H3,(H5,8,9,10,11,12)
InChI Key:
MEVRYHUXRSBWIB-UHFFFAOYSA-N
SMILES:
CCCCCNC(=N)NC(=S)N
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
188.293g/mol
Monoisotopic Mass:
188.11g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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