Home Other Building Blocks [1-(phenylsulfanyl)cyclopropyl]methanamine

[1-(phenylsulfanyl)cyclopropyl]methanamine

CAS No.:
1311314-26-7
Catalog Number:
AG01AH68
Molecular Formula:
C10H13NS
Molecular Weight:
179.2819
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Product Description
Catalog Number:
AG01AH68
Chemical Name:
[1-(phenylsulfanyl)cyclopropyl]methanamine
CAS Number:
1311314-26-7
Molecular Formula:
C10H13NS
Molecular Weight:
179.2819
MDL Number:
MFCD18483219
IUPAC Name:
(1-phenylsulfanylcyclopropyl)methanamine
InChI:
InChI=1S/C10H13NS/c11-8-10(6-7-10)12-9-4-2-1-3-5-9/h1-5H,6-8,11H2
InChI Key:
XVHVQEQFDFBYTE-UHFFFAOYSA-N
SMILES:
NCC1(CC1)Sc1ccccc1
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.077g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.281g/mol
Monoisotopic Mass:
179.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties