Chemical ID: 7086553

CC(CNCc1cccc(c1)Cl)O
Chemical ID:
7086553
Name [?]:
1-[(3-chlorophenyl)methylamino]propan-2-ol
SMILES [?]:
CC(CNCc1cccc(c1)Cl)O
InChi [?]:
InChI=1/C10H14ClNO/c1-8(13)6-12-7-9-3-2-4-10(11)5-9/h2-5,8,12-13H,6-7H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,7,9,11,3,5,2,6,10,12,4,13/rA:13cCCCNCCCCCCCClO/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s10;s2;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14ClNO
All Atoms:27
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:7.08206
Area:392.502
Solvation:-2.7305
Coulombic:-26.5278
Bond Count [?]
All:13
Single:10
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:199.677
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.91
LogP (Chemaxon):2.06

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Descriptor Annotations

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