Home Halogens (8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)methanol

(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)methanol

CAS No.:
852399-55-4
Catalog Number:
AG00IDLM
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
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Product Description
Catalog Number:
AG00IDLM
Chemical Name:
(8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)methanol
CAS Number:
852399-55-4
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD06655504
IUPAC Name:
(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methanol
InChI:
InChI=1S/C9H9ClO3/c10-7-3-6(5-11)4-8-9(7)13-2-1-12-8/h3-4,11H,1-2,5H2
InChI Key:
NZTJZGZSCQLALN-UHFFFAOYSA-N
SMILES:
OCc1cc2OCCOc2c(c1)Cl
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.024g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.618g/mol
Monoisotopic Mass:
200.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties