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175136-45-5 | Benzaldehyde, 4-pentyl-, oxime
CAS No: 175136-45-5 Catalog No: AG00208Q MDL No:
Product Description
Catalog Number:
AG00208Q
Chemical Name:
Benzaldehyde, 4-pentyl-, oxime
CAS Number:
175136-45-5
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
IUPAC Name:
N-[(4-pentylphenyl)methylidene]hydroxylamine
InChI:
InChI=1S/C12H17NO/c1-2-3-4-5-11-6-8-12(9-7-11)10-13-14/h6-10,14H,2-5H2,1H3
InChI Key:
RWRBIFAHYUXCHC-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(cc1)C=NO
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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