Home Halogens 2-(3-chloropropyl)-1,3-benzoxazole

2-(3-chloropropyl)-1,3-benzoxazole

CAS No.:
51111-00-3
Catalog Number:
AG019W7U
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
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Product Description
Catalog Number:
AG019W7U
Chemical Name:
2-(3-chloropropyl)-1,3-benzoxazole
CAS Number:
51111-00-3
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
MDL Number:
MFCD11187370
IUPAC Name:
2-(3-chloropropyl)-1,3-benzoxazole
InChI:
InChI=1S/C10H10ClNO/c11-7-3-6-10-12-8-4-1-2-5-9(8)13-10/h1-2,4-5H,3,6-7H2
InChI Key:
NCCSSFGYRMYCFK-UHFFFAOYSA-N
SMILES:
ClCCCc1nc2c(o1)cccc2
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.045g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.646g/mol
Monoisotopic Mass:
195.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties