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1021392-83-5 | 3-Oxetanemethanamine, 3-[(phenylmethyl)amino]-
CAS No: 1021392-83-5 Catalog No: AG0006PI MDL No:MFCD17168407
Product Description
Catalog Number:
AG0006PI
Chemical Name:
3-Oxetanemethanamine, 3-[(phenylmethyl)amino]-
CAS Number:
1021392-83-5
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
MDL Number:
MFCD17168407
IUPAC Name:
3-(aminomethyl)-N-benzyloxetan-3-amine
InChI:
InChI=1S/C11H16N2O/c12-7-11(8-14-9-11)13-6-10-4-2-1-3-5-10/h1-5,13H,6-9,12H2
InChI Key:
KIIWSWUJHJELRW-UHFFFAOYSA-N
SMILES:
NCC1(NCc2ccccc2)COC1
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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