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126909-78-2 | Benzene, 1-bromo-3-(cyclopropylmethoxy)-
CAS No: 126909-78-2 Catalog No: AG000TG3 MDL No:MFCD12138830
Product Description
Catalog Number:
AG000TG3
Chemical Name:
Benzene, 1-bromo-3-(cyclopropylmethoxy)-
CAS Number:
126909-78-2
Molecular Formula:
C10H11BrO
Molecular Weight:
227.0977
MDL Number:
MFCD12138830
IUPAC Name:
1-bromo-3-(cyclopropylmethoxy)benzene
InChI:
InChI=1S/C10H11BrO/c11-9-2-1-3-10(6-9)12-7-8-4-5-8/h1-3,6,8H,4-5,7H2
InChI Key:
QYVPRMAOEXVFHH-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)OCC1CC1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.999g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.101g/mol
Monoisotopic Mass:
225.999g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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