73667229 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 50 50 50 50 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 3 3 4 4 5 5 5 6 6 6 7 7 7 8 8 8 9 9 9 10 10 10 11 11 11 12 12 12 13 13 13 14 14 14 15 15 15 16 16 16 17 17 17 18 18 18 19 19 19 20 20 20 21 21 21 22 22 22 23 23 23 24 24 24 25 25 25 26 26 26 27 27 27 28 28 28 5 6 7 8 9 10 11 12 13 14 29 15 16 30 17 18 31 19 20 32 21 22 33 23 24 34 25 26 35 27 28 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 8.807 8.807 2.269 8.807 7.9409 9.673 7.9409 9.673 1.403 3.135 7.9409 9.673 7.0749 7.9409 10.539 9.673 7.0749 7.9409 10.539 9.673 0.5369 1.403 4.001 3.135 7.0749 7.9409 10.539 9.673 7.404 9.136 7.404 9.673 1.403 3.135 7.404 9.136 7.3849 6.538 6.7649 7.3209 7.9409 8.5609 10.849 11.0759 10.229 9.053 9.673 10.293 7.3849 6.538 6.7649 7.3209 7.9409 8.5609 10.849 11.0759 10.229 9.053 9.673 10.293 0.8469 0 0.2269 0.783 1.403 2.023 4.311 4.538 3.691 2.515 3.135 3.755 7.3849 6.538 6.7649 7.3209 7.9409 8.5609 10.849 11.0759 10.229 9.053 9.673 10.293 6.7769 11.4339 6.7769 2.12 6.2769 6.2769 10.9339 10.9339 6.2769 6.2769 1.62 1.62 6.7769 5.2769 6.7769 5.2769 11.4339 9.9339 11.4339 9.9339 6.7769 5.2769 6.7769 5.2769 2.12 0.62 2.12 0.62 5.9669 5.9669 10.6239 11.5539 6.8969 6.8969 1.31 1.31 7.3139 7.0869 6.24 5.2769 4.6569 5.2769 6.24 7.0869 7.3139 5.2769 4.6569 5.2769 11.9708 11.7439 10.8969 9.9339 9.3139 9.9339 10.8969 11.7439 11.9708 9.9339 9.3139 9.9339 7.3139 7.0869 6.24 5.2769 4.6569 5.2769 6.24 7.0869 7.3139 5.2769 4.6569 5.2769 2.6569 2.43 1.5831 0.62 0 0.62 1.5831 2.43 2.6569 0.62 0 0.62 0 Compound Canonicalized 5 2012.11.26 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 33.4 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 8 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371F07800000000000000008000000000000000000000000000000000000000000000000018000000000008008000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 diisopropyltin IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 di(propan-2-yl)tin IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 di(propan-2-yl)tin IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 di(propan-2-yl)tin IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 di(propan-2-yl)tin IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 diisopropyltin InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/8C3H7.4Sn/c8*1-3-2;;;;/h8*3H,1-2H3;;;; InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 HSVZRURNJXSEEL-UHFFFAOYSA-N Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 818.04596 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C24H56Sn4 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 819.5 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C.CC(C)[Sn]C(C)C Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 824.04701 28 0 0 0 0 0 0 0 4 -1