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75971-37-8 | Acetaldehyde, [(phenylmethyl)amino]-
CAS No: 75971-37-8 Catalog No: AG005GYM MDL No:
Product Description
Catalog Number:
AG005GYM
Chemical Name:
Acetaldehyde, [(phenylmethyl)amino]-
CAS Number:
75971-37-8
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
2-(benzylamino)acetaldehyde
InChI:
InChI=1S/C9H11NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,7,10H,6,8H2
InChI Key:
ONGYYRQSCJYQHL-UHFFFAOYSA-N
SMILES:
O=CCNCc1ccccc1
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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