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832724-75-1 | Aziridine, 2-(bromomethyl)-1-[(3-methoxyphenyl)methyl]-
CAS No: 832724-75-1 Catalog No: AG004XWS MDL No:
Product Description
Catalog Number:
AG004XWS
Chemical Name:
Aziridine, 2-(bromomethyl)-1-[(3-methoxyphenyl)methyl]-
CAS Number:
832724-75-1
Molecular Formula:
C11H14BrNO
Molecular Weight:
256.1390
IUPAC Name:
2-(bromomethyl)-1-[(3-methoxyphenyl)methyl]aziridine
InChI:
InChI=1S/C11H14BrNO/c1-14-11-4-2-3-9(5-11)7-13-8-10(13)6-12/h2-5,10H,6-8H2,1H3
InChI Key:
KXNSOYVFWZNABF-UHFFFAOYSA-N
SMILES:
BrCC1CN1Cc1cccc(c1)OC
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.026g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.143g/mol
Monoisotopic Mass:
255.026g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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