Home Carbonyls [4-(azepane-1-carbonyl)phenyl]methanamine hydrochloride

[4-(azepane-1-carbonyl)phenyl]methanamine hydrochloride

CAS No.:
1158361-97-7
Catalog Number:
AG019MWI
Molecular Formula:
C14H21ClN2O
Molecular Weight:
268.7823
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Product Description
Catalog Number:
AG019MWI
Chemical Name:
[4-(azepane-1-carbonyl)phenyl]methanamine hydrochloride
CAS Number:
1158361-97-7
Molecular Formula:
C14H21ClN2O
Molecular Weight:
268.7823
MDL Number:
MFCD11099565
IUPAC Name:
[4-(aminomethyl)phenyl]-(azepan-1-yl)methanone;hydrochloride
InChI:
InChI=1S/C14H20N2O.ClH/c15-11-12-5-7-13(8-6-12)14(17)16-9-3-1-2-4-10-16;/h5-8H,1-4,9-11,15H2;1H
InChI Key:
ZGPNUULPMGBPOF-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)C(=O)N1CCCCCC1.Cl
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.134g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.785g/mol
Monoisotopic Mass:
268.134g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties