Home Aldehydes 2-Methoxyhexahydropyrimidine-5-carbaldehyde

2-Methoxyhexahydropyrimidine-5-carbaldehyde

CAS No.:
1956319-01-9
Catalog Number:
AG00I3EV
Molecular Formula:
C6H12N2O2
Molecular Weight:
144.1717
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Product Description
Catalog Number:
AG00I3EV
Chemical Name:
2-Methoxyhexahydropyrimidine-5-carbaldehyde
CAS Number:
1956319-01-9
Molecular Formula:
C6H12N2O2
Molecular Weight:
144.1717
IUPAC Name:
2-methoxy-1,3-diazinane-5-carbaldehyde
InChI:
InChI=1S/C6H12N2O2/c1-10-6-7-2-5(4-9)3-8-6/h4-8H,2-3H2,1H3
InChI Key:
DIQQXPTXYARVIR-UHFFFAOYSA-N
SMILES:
COC1NCC(CN1)C=O
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.09g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.174g/mol
Monoisotopic Mass:
144.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties