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1225889-66-6 | 2H-1,4-Benzoxazine-6-methanamine, 3,4-dihydro-4-methyl-
CAS No: 1225889-66-6 Catalog No: AG0017H6 MDL No:MFCD16470790
Product Description
Catalog Number:
AG0017H6
Chemical Name:
2H-1,4-Benzoxazine-6-methanamine, 3,4-dihydro-4-methyl-
CAS Number:
1225889-66-6
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
MDL Number:
MFCD16470790
IUPAC Name:
(4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)methanamine
InChI:
InChI=1S/C10H14N2O/c1-12-4-5-13-10-3-2-8(7-11)6-9(10)12/h2-3,6H,4-5,7,11H2,1H3
InChI Key:
LXNCLOFEBQGMHA-UHFFFAOYSA-N
SMILES:
NCc1ccc2c(c1)N(C)CCO2
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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