Home Other Building Blocks N-(3-isothiocyanatopropyl)-N-methylaniline

N-(3-isothiocyanatopropyl)-N-methylaniline

CAS No.:
53485-00-0
Catalog Number:
AG01A9I0
Molecular Formula:
C11H14N2S
Molecular Weight:
206.3073
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01A9I0
Chemical Name:
N-(3-isothiocyanatopropyl)-N-methylaniline
CAS Number:
53485-00-0
Molecular Formula:
C11H14N2S
Molecular Weight:
206.3073
MDL Number:
MFCD11131109
IUPAC Name:
N-(3-isothiocyanatopropyl)-N-methylaniline
InChI:
InChI=1S/C11H14N2S/c1-13(9-5-8-12-10-14)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChI Key:
YNXCEEIXYZPQGC-UHFFFAOYSA-N
SMILES:
CN(c1ccccc1)CCCN=C=S
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.088g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.307g/mol
Monoisotopic Mass:
206.088g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
47.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties