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Home Carboxys methyl 1-methyl-1,4-diazepane-2-carboxylate dihydrochloride

methyl 1-methyl-1,4-diazepane-2-carboxylate dihydrochloride

CAS No.:
1609395-93-8
Catalog Number:
AG00J2G1
Molecular Formula:
C8H18Cl2N2O2
Molecular Weight:
245.1467
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG00J2G1
Chemical Name:
methyl 1-methyl-1,4-diazepane-2-carboxylate dihydrochloride
CAS Number:
1609395-93-8
Molecular Formula:
C8H18Cl2N2O2
Molecular Weight:
245.1467
MDL Number:
MFCD26959335
IUPAC Name:
methyl 1-methyl-1,4-diazepane-2-carboxylate;dihydrochloride
InChI:
InChI=1S/C8H16N2O2.2ClH/c1-10-5-3-4-9-6-7(10)8(11)12-2;;/h7,9H,3-6H2,1-2H3;2*1H
InChI Key:
RQDCBTOADDDFQO-UHFFFAOYSA-N
SMILES:
COC(=O)C1CNCCCN1C.Cl.Cl
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
245.144g/mol
Monoisotopic Mass:
244.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties