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

[1-(phenylsulfanyl)cyclopentyl]methanamine

CAS No.:
1311314-42-7
Catalog Number:
AG01AH5A
Molecular Formula:
C12H17NS
Molecular Weight:
207.3351
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Product Description
Catalog Number:
AG01AH5A
Chemical Name:
[1-(phenylsulfanyl)cyclopentyl]methanamine
CAS Number:
1311314-42-7
Molecular Formula:
C12H17NS
Molecular Weight:
207.3351
MDL Number:
MFCD18483203
IUPAC Name:
(1-phenylsulfanylcyclopentyl)methanamine
InChI:
InChI=1S/C12H17NS/c13-10-12(8-4-5-9-12)14-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10,13H2
InChI Key:
SHPPFZWGGRFORD-UHFFFAOYSA-N
SMILES:
NCC1(CCCC1)Sc1ccccc1
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.108g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.335g/mol
Monoisotopic Mass:
207.108g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties