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130136-59-3 | Benzenamine, N-hydroxy-4-methyl-N-2-propyn-1-yl-
CAS No: 130136-59-3 Catalog No: AG000U1S MDL No:
Product Description
Catalog Number:
AG000U1S
Chemical Name:
Benzenamine, N-hydroxy-4-methyl-N-2-propyn-1-yl-
CAS Number:
130136-59-3
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
N-(4-methylphenyl)-N-prop-2-ynylhydroxylamine
InChI:
InChI=1S/C10H11NO/c1-3-8-11(12)10-6-4-9(2)5-7-10/h1,4-7,12H,8H2,2H3
InChI Key:
MDWYWCZJMBYKDC-UHFFFAOYSA-N
SMILES:
ON(c1ccc(cc1)C)CC#C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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