Home Other Building Blocks 1-[(3-hydroxyphenyl)imino]-1lambda6-thiolan-1-one

1-[(3-hydroxyphenyl)imino]-1lambda6-thiolan-1-one

CAS No.:
1955519-93-3
Catalog Number:
AG01B2BC
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
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Product Description
Catalog Number:
AG01B2BC
Chemical Name:
1-[(3-hydroxyphenyl)imino]-1lambda6-thiolan-1-one
CAS Number:
1955519-93-3
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD29907371
IUPAC Name:
3-[(1-oxothiolan-1-ylidene)amino]phenol
InChI:
InChI=1S/C10H13NO2S/c12-10-5-3-4-9(8-10)11-14(13)6-1-2-7-14/h3-5,8,12H,1-2,6-7H2
InChI Key:
PREBUROIKCTTJR-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)N=S1(=O)CCCC1
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties