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101326-49-2 | Urea, N-(2-cyanoethyl)-N-(2-hydroxyethyl)-
CAS No: 101326-49-2 Catalog No: AG00047N MDL No:
Product Description
Catalog Number:
AG00047N
Chemical Name:
Urea, N-(2-cyanoethyl)-N-(2-hydroxyethyl)-
CAS Number:
101326-49-2
Molecular Formula:
C6H11N3O2
Molecular Weight:
157.1704
IUPAC Name:
1-(2-cyanoethyl)-1-(2-hydroxyethyl)urea
InChI:
InChI=1S/C6H11N3O2/c7-2-1-3-9(4-5-10)6(8)11/h10H,1,3-5H2,(H2,8,11)
InChI Key:
YRDGMEVUXKPGMJ-UHFFFAOYSA-N
SMILES:
OCCN(C(=O)N)CCC#N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.085g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.173g/mol
Monoisotopic Mass:
157.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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