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118743-81-0 | (R)-N-(α-Methylbenzyl)hydroxylamine oxalate salt
CAS No: 118743-81-0 Catalog No: AG003CBH MDL No:MFCD11656048
Product Description
Catalog Number:
AG003CBH
Chemical Name:
(R)-N-(α-Methylbenzyl)hydroxylamine oxalate salt
CAS Number:
118743-81-0
Molecular Formula:
C10H13NO5
Molecular Weight:
227.2139
MDL Number:
MFCD11656048
IUPAC Name:
oxalic acid;N-[(1R)-1-phenylethyl]hydroxylamine
InChI:
InChI=1S/C8H11NO.C2H2O4/c1-7(9-10)8-5-3-2-4-6-8;3-1(4)2(5)6/h2-7,9-10H,1H3;(H,3,4)(H,5,6)/t7-;/m1./s1
InChI Key:
GUXMGLCOBSBIKH-OGFXRTJISA-N
SMILES:
OC(=O)C(=O)O.ON[C@@H](c1ccccc1)C
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
227.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
227.216g/mol
Monoisotopic Mass:
227.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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