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Home > Aldehydes > 784102-54-1
784102-54-1 | BENZALDEHYDE, 3-(1-AZIRIDINYL)-
CAS No: 784102-54-1 Catalog No: AG005M82 MDL No:
Product Description
Catalog Number:
AG005M82
Chemical Name:
BENZALDEHYDE, 3-(1-AZIRIDINYL)-
CAS Number:
784102-54-1
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
IUPAC Name:
3-(aziridin-1-yl)benzaldehyde
InChI:
InChI=1S/C9H9NO/c11-7-8-2-1-3-9(6-8)10-4-5-10/h1-3,6-7H,4-5H2
InChI Key:
WAMJWMOKWJUAAZ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)N1CC1
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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