Chemical namedichloromethane
CAS RN75-09-2
SMILESClCCl
FORMULACH2Cl2
Molecular weight83.953
Properties
Descriptor: Difference (Pos - Neg) in Charged Surface Areas (Zefirov) 0.0
Descriptor: min(#HA, #HD) (AM1) 0.0
Descriptor: count of H-acceptor sites (AM1) 0.0
Descriptor: FHACA Fractional HACA (HACA/TMSA) (AM1) 0.0
Descriptor: HACA-2 (AM1),Number of O atoms 0.0
Descriptor: Average atom weight 16.9865
Descriptor: Negatively Charged Part of Charged Surface Area (AM1) -94.0612
Descriptor: HBCA H-bonding charged surface area (AM1) 0.0
Found in following QMRFs:
# QMRF# help Title help Version help Last updated help Found in help View Download help
1 Q17-22-1-332 Nonlinear QSAR: artificial neural network for dermal irritation 1 Dermal_Irritation_PII_test_20.sdf (data_validation) View Attachment(s) available (4) html.png pdf.png xls.png xml.png

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