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88497-03-4 | Thiourea,N-(hydroxymethyl)-N-methyl-
CAS No: 88497-03-4 Catalog No: AG0049AN MDL No:
Product Description
Catalog Number:
AG0049AN
Chemical Name:
Thiourea,N-(hydroxymethyl)-N-methyl-
CAS Number:
88497-03-4
Molecular Formula:
C3H8N2OS
Molecular Weight:
120.1734
IUPAC Name:
1-(hydroxymethyl)-1-methylthiourea
InChI:
InChI=1S/C3H8N2OS/c1-5(2-6)3(4)7/h6H,2H2,1H3,(H2,4,7)
InChI Key:
ZCISWUZGJRMGGW-UHFFFAOYSA-N
SMILES:
CN(C(=S)N)CO
Properties
Complexity:
75.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.036g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
120.17g/mol
Monoisotopic Mass:
120.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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