Chemical ID: 5827780

c1ccc(c(c1)NC(=O)C2CC2)Br
Chemical ID:
5827780
Name [?]:
N-(2-bromophenyl)cyclopropanecarboxamide
SMILES [?]:
c1ccc(c(c1)NC(=O)C2CC2)Br
InChi [?]:
InChI=1/C10H10BrNO/c11-8-3-1-2-4-9(8)12-10(13)7-5-6-7/h1-4,7H,5-6H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:2,1,3,6,11,12,10,4,5,8,13,7,9/E:(5,6)/rA:13nCCCCCCNCOCCCBr/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s10s11;s4;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10BrNO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.52748
Area:359.988
Solvation:-1.47222
Coulombic:-21.3383
Bond Count [?]
All:14
Single:10
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:240.097
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.28
LogP (Chemaxon):2.2

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