Home Aminos 3-(Diethylamino)propyl isothiocyanate

3-(Diethylamino)propyl isothiocyanate

CAS No.:
2626-52-0
Catalog Number:
AG002SHM
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
85%
In Stock USA
United States
$50
- +
5g
85%
In Stock USA
United States
$200
- +
Product Description
Catalog Number:
AG002SHM
Chemical Name:
3-(Diethylamino)propyl isothiocyanate
CAS Number:
2626-52-0
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
MDL Number:
MFCD00041133
IUPAC Name:
N,N-diethyl-3-isothiocyanatopropan-1-amine
InChI:
InChI=1S/C8H16N2S/c1-3-10(4-2)7-5-6-9-8-11/h3-7H2,1-2H3
InChI Key:
QPBVKSLJBRCKIF-UHFFFAOYSA-N
SMILES:
S=C=NCCCN(CC)CC
Properties
Complexity:
126  
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:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.29g/mol
Monoisotopic Mass:
172.103g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties