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1515-89-5 | Benzene, 1-bromo-3-(methoxymethyl)-
CAS No: 1515-89-5 Catalog No: AG001NDG MDL No:MFCD11504955
Product Description
Catalog Number:
AG001NDG
Chemical Name:
Benzene, 1-bromo-3-(methoxymethyl)-
CAS Number:
1515-89-5
Molecular Formula:
C8H9BrO
Molecular Weight:
201.0605
MDL Number:
MFCD11504955
IUPAC Name:
1-bromo-3-(methoxymethyl)benzene
InChI:
InChI=1S/C8H9BrO/c1-10-6-7-3-2-4-8(9)5-7/h2-5H,6H2,1H3
InChI Key:
BZYGFMKYRKQSQG-UHFFFAOYSA-N
SMILES:
COCc1cccc(c1)Br
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.984g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.063g/mol
Monoisotopic Mass:
199.984g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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