Home Other Building Blocks 3-Allyl-1,1-diethylthiourea

3-Allyl-1,1-diethylthiourea

CAS No.:
21645-26-1
Catalog Number:
AG00BCP1
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$67
- +
1g
1 week
United States
$95
- +
Product Description
Catalog Number:
AG00BCP1
Chemical Name:
3-Allyl-1,1-diethylthiourea
CAS Number:
21645-26-1
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
MDL Number:
MFCD00048529
IUPAC Name:
1,1-diethyl-3-prop-2-enylthiourea
InChI:
InChI=1S/C8H16N2S/c1-4-7-9-8(11)10(5-2)6-3/h4H,1,5-7H2,2-3H3,(H,9,11)
InChI Key:
QADMBPYDNAHONY-UHFFFAOYSA-N
SMILES:
CCN(C(=S)NCC=C)CC
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.103g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.29g/mol
Monoisotopic Mass:
172.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties