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1353959-23-5 | N*1*-(4-Methoxy-cyclohexyl)-ethane-1,2-diamine
CAS No: 1353959-23-5 Catalog No: AG01FA29 MDL No:
Product Description
Catalog Number:
AG01FA29
Chemical Name:
N*1*-(4-Methoxy-cyclohexyl)-ethane-1,2-diamine
CAS Number:
1353959-23-5
Molecular Formula:
C9H20N2O
Molecular Weight:
172.2679
IUPAC Name:
N'-(4-methoxycyclohexyl)ethane-1,2-diamine
InChI:
InChI=1S/C9H20N2O/c1-12-9-4-2-8(3-5-9)11-7-6-10/h8-9,11H,2-7,10H2,1H3
InChI Key:
VCHGGXYASKOEAO-UHFFFAOYSA-N
SMILES:
NCCNC1CCC(CC1)OC
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.158g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.272g/mol
Monoisotopic Mass:
172.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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