Chemical ID: 4214869

CC(C(=O)O)NC(=O)c1ccccc1
Chemical ID:
4214869
Name [?]:
2-benzamidopropanoic acid
SMILES [?]:
CC(C(=O)O)NC(=O)c1ccccc1
InChi [?]:
InChI=1/C10H11NO3/c1-7(10(13)14)11-9(12)8-5-3-2-4-6-8/h2-7H,1H3,(H,11,12)(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,12,11,13,10,14,2,9,7,3,6,8,4,5/E:(3,4)(5,6)(13,14)/rA:14cCCCOONCOCCCCCC/rB:s1;s2;d3;s3;s2;s6;d7;s7;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11NO3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.07773
Area:371.297
Solvation:-2.20469
Coulombic:-50.1987
Bond Count [?]
All:14
Single:9
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:193.199
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.34
LogP (Chemaxon):1.02

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