Chemical ID: 6681935

c1ccc(cc1)CC(CO)N
Chemical ID:
6681935
Name [?]:
2-amino-3-phenyl-propan-1-ol
SMILES [?]:
c1ccc(cc1)CC(CO)N
InChi [?]:
InChI=1/C9H13NO/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9,11H,6-7,10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,7,9,4,8,11,10/E:(2,3)(4,5)/rA:11cCCCCCCCCCON/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s8;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H13NO
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:5.46262
Area:323.699
Solvation:-2.62985
Coulombic:-29.8759
Bond Count [?]
All:11
Single:8
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:151.206
H-Bond Donors:3
H-Bond Acceptors:2
XLogP:0.63
LogP (Chemaxon):1.04

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue