Home Other Building Blocks (6-methylheptan-2-yl)thiourea

(6-methylheptan-2-yl)thiourea

CAS No.:
747411-48-9
Catalog Number:
AG019JIV
Molecular Formula:
C9H20N2S
Molecular Weight:
188.3335
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG019JIV
Chemical Name:
(6-methylheptan-2-yl)thiourea
CAS Number:
747411-48-9
Molecular Formula:
C9H20N2S
Molecular Weight:
188.3335
MDL Number:
MFCD05270912
IUPAC Name:
6-methylheptan-2-ylthiourea
InChI:
InChI=1S/C9H20N2S/c1-7(2)5-4-6-8(3)11-9(10)12/h7-8H,4-6H2,1-3H3,(H3,10,11,12)
InChI Key:
AUEXUZQBMAFOBJ-UHFFFAOYSA-N
SMILES:
CC(NC(=S)N)CCCC(C)C
Properties
Complexity:
135  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.135g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
188.333g/mol
Monoisotopic Mass:
188.135g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties