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136637-84-8 | Propanoic acid, 3-imino-3-propoxy-, propyl ester, hydrochloride (1:1)
CAS No: 136637-84-8 Catalog No: AG00125V MDL No:
Product Description
Catalog Number:
AG00125V
Chemical Name:
Propanoic acid, 3-imino-3-propoxy-, propyl ester, hydrochloride (1:1)
CAS Number:
136637-84-8
Molecular Formula:
C9H18ClNO3
Molecular Weight:
223.6971
IUPAC Name:
propyl 3-imino-3-propoxypropanoate;hydrochloride
InChI:
InChI=1S/C9H17NO3.ClH/c1-3-5-12-8(10)7-9(11)13-6-4-2;/h10H,3-7H2,1-2H3;1H
InChI Key:
UCFUSTOSVKKJCQ-UHFFFAOYSA-N
SMILES:
CCCOC(=N)CC(=O)OCCC.Cl
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.697g/mol
Monoisotopic Mass:
223.098g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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