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127879-23-6 | Thiourea, N-methyl-N-2-propen-1-yl-
CAS No: 127879-23-6 Catalog No: AG000XHJ MDL No:
Product Description
Catalog Number:
AG000XHJ
Chemical Name:
Thiourea, N-methyl-N-2-propen-1-yl-
CAS Number:
127879-23-6
Molecular Formula:
C5H10N2S
Molecular Weight:
130.2113
IUPAC Name:
1-methyl-1-prop-2-enylthiourea
InChI:
InChI=1S/C5H10N2S/c1-3-4-7(2)5(6)8/h3H,1,4H2,2H3,(H2,6,8)
InChI Key:
GXQGTKHOKKMQHL-UHFFFAOYSA-N
SMILES:
CN(C(=S)N)CC=C
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.056g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
130.209g/mol
Monoisotopic Mass:
130.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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