D2P
Summary
Name: | (2S)-2,3-DICHLOROPROPAN-1-OL |
Formula: | C3 H6 Cl2 O |
Formal charge: | 0 |
Formula weight: | 128.985 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | (2S)-2,3-dichloropropan-1-ol |
OpenEye OEToolkits | 1.5.0 | (2S)-2,3-dichloropropan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | ClCC(Cl)CO |
SMILES_CANONICAL | CACTVS | 3.341 | OC[C@H](Cl)CCl |
SMILES | CACTVS | 3.341 | OC[CH](Cl)CCl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H](CCl)Cl)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(CCl)Cl)O |
InChI | InChI | 1.03 | InChI=1S/C3H6Cl2O/c4-1-3(5)2-6/h3,6H,1-2H2/t3-/m1/s1 |
InChIKey | InChI | 1.03 | ZXCYIJGIGSDJQQ-GSVOUGTGSA-N |