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14569-86-9 | Thiourea, N-[2-(dimethylamino)ethyl]-N'-phenyl-
CAS No: 14569-86-9 Catalog No: AG001DBA MDL No:
Product Description
Catalog Number:
AG001DBA
Chemical Name:
Thiourea, N-[2-(dimethylamino)ethyl]-N'-phenyl-
CAS Number:
14569-86-9
Molecular Formula:
C11H17N3S
Molecular Weight:
223.3378
IUPAC Name:
1-[2-(dimethylamino)ethyl]-3-phenylthiourea
InChI:
InChI=1S/C11H17N3S/c1-14(2)9-8-12-11(15)13-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H2,12,13,15)
InChI Key:
UTPHDUQSIDZRRH-UHFFFAOYSA-N
SMILES:
CN(CCNC(=S)Nc1ccccc1)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.114g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.338g/mol
Monoisotopic Mass:
223.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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