Home Other Building Blocks 2-(azepan-4-yl)acetic acid hydrochloride

2-(azepan-4-yl)acetic acid hydrochloride

CAS No.:
2098128-87-9
Catalog Number:
AG01ELK1
Molecular Formula:
C8H16ClNO2
Molecular Weight:
193.6711
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Product Description
Catalog Number:
AG01ELK1
Chemical Name:
2-(azepan-4-yl)acetic acid hydrochloride
CAS Number:
2098128-87-9
Molecular Formula:
C8H16ClNO2
Molecular Weight:
193.6711
MDL Number:
MFCD30494701
IUPAC Name:
2-(azepan-4-yl)acetic acid;hydrochloride
InChI:
InChI=1S/C8H15NO2.ClH/c10-8(11)6-7-2-1-4-9-5-3-7;/h7,9H,1-6H2,(H,10,11);1H
InChI Key:
UOVHMPARHFKDGW-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCNCCC1.Cl
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.087g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
193.671g/mol
Monoisotopic Mass:
193.087g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties