Home Other Building Blocks (3-isothiocyanato-2,2-dimethylpropyl)dimethylamine

(3-isothiocyanato-2,2-dimethylpropyl)dimethylamine

CAS No.:
1019119-63-1
Catalog Number:
AG01A9OM
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
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Product Description
Catalog Number:
AG01A9OM
Chemical Name:
(3-isothiocyanato-2,2-dimethylpropyl)dimethylamine
CAS Number:
1019119-63-1
Molecular Formula:
C8H16N2S
Molecular Weight:
172.2910
MDL Number:
MFCD11131125
IUPAC Name:
3-isothiocyanato-N,N,2,2-tetramethylpropan-1-amine
InChI:
InChI=1S/C8H16N2S/c1-8(2,5-9-7-11)6-10(3)4/h5-6H2,1-4H3
InChI Key:
CXMXFACHOSRRHN-UHFFFAOYSA-N
SMILES:
CN(CC(CN=C=S)(C)C)C
Properties
Complexity:
158  
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:
4  
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties