Home Carboxys methyl 6-formyl-3,4-dihydro-2H-oxazine-4-carboxylate

methyl 6-formyl-3,4-dihydro-2H-oxazine-4-carboxylate

CAS No.:
2137574-52-6
Catalog Number:
AG01EMA9
Molecular Formula:
C7H9NO4
Molecular Weight:
171.1507
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EMA9
Chemical Name:
methyl 6-formyl-3,4-dihydro-2H-oxazine-4-carboxylate
CAS Number:
2137574-52-6
Molecular Formula:
C7H9NO4
Molecular Weight:
171.1507
MDL Number:
MFCD31559394
IUPAC Name:
methyl 6-formyl-2,3-dihydro-1,4-oxazine-4-carboxylate
InChI:
InChI=1S/C7H9NO4/c1-11-7(10)8-2-3-12-6(4-8)5-9/h4-5H,2-3H2,1H3
InChI Key:
BREQJLYSGKYESH-UHFFFAOYSA-N
SMILES:
COC(=O)N1CCOC(=C1)C=O
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.152g/mol
Monoisotopic Mass:
171.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties