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113437-88-0 | Carbamic acid, [2-(aminooxy)ethyl]-, phenylmethyl ester, hydrochloride (9CI)
CAS No: 113437-88-0 Catalog No: AG0008LL MDL No:
Product Description
Catalog Number:
AG0008LL
Chemical Name:
Carbamic acid, [2-(aminooxy)ethyl]-, phenylmethyl ester, hydrochloride (9CI)
CAS Number:
113437-88-0
Molecular Formula:
C10H15ClN2O3
Molecular Weight:
246.6907
IUPAC Name:
benzyl N-(2-aminooxyethyl)carbamate;hydrochloride
InChI:
InChI=1S/C10H14N2O3.ClH/c11-15-7-6-12-10(13)14-8-9-4-2-1-3-5-9;/h1-5H,6-8,11H2,(H,12,13);1H
InChI Key:
MPWJKZFJINKPAB-UHFFFAOYSA-N
SMILES:
NOCCNC(=O)OCc1ccccc1.Cl
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.077g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
246.691g/mol
Monoisotopic Mass:
246.077g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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