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Home > Aldehydes > 209919-81-3
209919-81-3 | 4-[3-(DIMETHYLAMINO)PROP-1-YNYL]BENZALDEHYDE OXIME
CAS No: 209919-81-3 Catalog No: AG00708P MDL No:
Product Description
Catalog Number:
AG00708P
Chemical Name:
4-[3-(DIMETHYLAMINO)PROP-1-YNYL]BENZALDEHYDE OXIME
CAS Number:
209919-81-3
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
N-[[4-[3-(dimethylamino)prop-1-ynyl]phenyl]methylidene]hydroxylamine
InChI:
InChI=1S/C12H14N2O/c1-14(2)9-3-4-11-5-7-12(8-6-11)10-13-15/h5-8,10,15H,9H2,1-2H3
InChI Key:
KCAYJJSGXZVSAB-UHFFFAOYSA-N
SMILES:
ON=Cc1ccc(cc1)C#CCN(C)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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