Chemical ID: 3965854

CC(c1ccc2c3cc(ccc3[nH]c2c1)Cl)C(=O)O
Chemical ID:
3965854
Name [?]:
2-(6-chloro-9H-carbazol-2-yl)propanoic acid
SMILES [?]:
CC(c1ccc2c3cc(ccc3[nH]c2c1)Cl)C(=O)O
InChi [?]:
InChI=1/C15H12ClNO2/c1-8(15(18)19)9-2-4-11-12-7-10(16)3-5-13(12)17-14(11)6-9/h2-8,17H,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,4,10,5,11,15,8,2,3,9,6,7,12,14,17,16,13,18,19/E:(18,19)/rA:19cCCCCCCCCCCCCNCCClCOO/rB:s1;s2;s3;d4;s5;s6;s7;d8;s9;d10;d7s11;s12;d6s13;d3s14;s9;s2;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12ClNO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:8.92453
Area:449.105
Solvation:-2.30309
Coulombic:-38.9306
Bond Count [?]
All:21
Single:14
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:273.714
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.79
LogP (Chemaxon):4.55

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