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183429-63-2

183429-63-2 | Cycloheptanecarboxylic acid, 1-amino-, methyl ester

CAS No: 183429-63-2 Catalog No: AG0027JT MDL No:MFCD03426282

Product Description

Catalog Number:
AG0027JT
Chemical Name:
Cycloheptanecarboxylic acid, 1-amino-, methyl ester
CAS Number:
183429-63-2
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD03426282
IUPAC Name:
methyl 1-aminocycloheptane-1-carboxylate
InChI:
InChI=1S/C9H17NO2/c1-12-8(11)9(10)6-4-2-3-5-7-9/h2-7,10H2,1H3
InChI Key:
GPZHQNYVDQMZDP-UHFFFAOYSA-N
SMILES:
COC(=O)C1(N)CCCCCC1

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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