Home Other Building Blocks 7-Bromochroman

7-Bromochroman

CAS No.:
941710-30-1
Catalog Number:
AG003A5K
Molecular Formula:
C9H9BrO
Molecular Weight:
213.0712
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Product Description
Catalog Number:
AG003A5K
Chemical Name:
7-Bromochroman
CAS Number:
941710-30-1
Molecular Formula:
C9H9BrO
Molecular Weight:
213.0712
MDL Number:
MFCD08273918
IUPAC Name:
7-bromo-3,4-dihydro-2H-chromene
InChI:
InChI=1S/C9H9BrO/c10-8-4-3-7-2-1-5-11-9(7)6-8/h3-4,6H,1-2,5H2
InChI Key:
BCDHMTIEVNKNCV-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)OCCC2
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.984g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.074g/mol
Monoisotopic Mass:
211.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties