Home Other Building Blocks (2-methylbut-3-yn-2-yl)urea

(2-methylbut-3-yn-2-yl)urea

CAS No.:
32957-01-0
Catalog Number:
AG01C38T
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
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Product Description
Catalog Number:
AG01C38T
Chemical Name:
(2-methylbut-3-yn-2-yl)urea
CAS Number:
32957-01-0
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD00118852
IUPAC Name:
2-methylbut-3-yn-2-ylurea
InChI:
InChI=1S/C6H10N2O/c1-4-6(2,3)8-5(7)9/h1H,2-3H3,(H3,7,8,9)
InChI Key:
DWSYINQJVVITME-UHFFFAOYSA-N
SMILES:
C#CC(NC(=O)N)(C)C
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties