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852202-51-8 | Thiourea, N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N'-methyl-
CAS No: 852202-51-8 Catalog No: AG004VYC MDL No:
Product Description
Catalog Number:
AG004VYC
Chemical Name:
Thiourea, N-[(1R,2R)-2-(dimethylamino)cyclohexyl]-N'-methyl-
CAS Number:
852202-51-8
Molecular Formula:
C10H21N3S
Molecular Weight:
215.3588
IUPAC Name:
1-[(1R,2R)-2-(dimethylamino)cyclohexyl]-3-methylthiourea
InChI:
InChI=1S/C10H21N3S/c1-11-10(14)12-8-6-4-5-7-9(8)13(2)3/h8-9H,4-7H2,1-3H3,(H2,11,12,14)/t8-,9-/m1/s1
InChI Key:
NSNXUJHMJCYSAF-RKDXNWHRSA-N
SMILES:
CNC(=S)N[C@@H]1CCCC[C@H]1N(C)C
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
215.146g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.359g/mol
Monoisotopic Mass:
215.146g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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