Aminomethyl Propanediol
PubChem CID: 1531
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| Compound Synonyms | 2-Amino-2-methyl-1,3-propanediol, 115-69-5, 2-Amino-2-methylpropane-1,3-diol, AMPD, Aminoglycol, Gentimon, 1,3-Propanediol, 2-amino-2-methyl-, Aminomethyl propanediol, Isobutandiol-2-amine, Ammediol, 1,1-Di(hydroxymethyl)ethylamine, 2-Amino-2-methyl-1,3-propandiol, Amediol, NSC 6364, 2-AMINO-2-METHYLPROPANEDIOL, MFCD00004678, CZ7BU4QZJZ, EINECS 204-100-7, BRN 0635708, AI3-03949, 2-Amino-2-methylpropan-1,3-diol, 2-methyl-2-amino-1,3-propanediol, NSC-6364, 1,3-Dihydroxy-2-methyl-2-propylamine, 1,3-Dihydroxy-2-amino-2-methylpropane, CHEBI:991, DTXSID7059430, 4-04-00-01881 (Beilstein Handbook Reference), 2-AMINO-2-METHYL-1,3-PROPANEDIOL [MI], AMPO, UNII-CZ7BU4QZJZ, aminomethylpropanediol, 2-amino-2-methyl-propane-1,3-diol, 2Amino2methylpropanediol, 1, 2-amino-2-methyl-, 2Amino2methyl1,3propandiol, 2Amino2methylpropane1,3diol, SCHEMBL23687, 1,1Di(hydroxymethyl)ethylamine, 1,3Propanediol, 2amino2methyl, 1,3Dihydroxy2methyl2propylamine, DTXCID8033356, WLN: Q1XZ1 & 1Q, UXFQFBNBSPQBJW-UHFFFAOYSA-, NSC6364, 2-amino-2-methyl-1,3propanediol, 2-amino-2-methylpropane-1,3diol, 2-amino-2-methyl-1-3-propandiol, 2-amino-2-methylpropane 1,3-diol, 2-hydroxymethyl-2-amino-1-propanol, BBL027473, STL373468, AMINOMETHYL PROPANEDIOL [INCI], AKOS006222995, AT27658, CS-W017770, FA46974, HY-W017054, SB83841, 1,3-dihydroxy-2-methyl-2-amino-propane, DA-49361, SY011284, VS-08545, 2-Amino-2-methyl-1,3-propanediol(AMPD), propane, 2-amino-1,3-dihydroxy-2-methyl-, A0332, NS00007933, 2-Amino-2-methyl-1,3-propanediol, >=99%, EN300-93582, propane, 2-amino-3-hydroxy-2-hydroxymethyl-, Q3598002, F2190-0374, 95E0210B-CCBA-4485-9DA0-34844FF88E42, 2-Amino-2-methyl-1,3-propanediol, BioUltra, >=99.5% (NT), InChI=1/C4H11NO2/c1-4(5,2-6)3-7/h6-7H,2-3,5H2,1H3, 2-Amino-2-methyl-1,3-propanediol, BioXtra, pH 10.0-12.0 (20 C, 0.5 M in H2O), >=99%, 204-100-7 |
|---|---|
| Topological Polar Surface Area | 66.5 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 7.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 51.7 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-amino-2-methylpropane-1,3-diol |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Xlogp | -1.8 |
| Is Pains | False |
| Molecular Formula | C4H11NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | UXFQFBNBSPQBJW-UHFFFAOYSA-N |
| Fcsp3 | 1.0 |
| Rotatable Bond Count | 2.0 |
| Compound Name | Aminomethyl Propanediol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 105.079 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 105.079 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 105.14 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 0.7930505999999999 |
| Inchi | InChI=1S/C4H11NO2/c1-4(5,2-6)3-7/h6-7H,2-3,5H2,1H3 |
| Smiles | CC(CO)(CO)N |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Pogostemon Cablin (Plant) Rel Props:Source_db:cmaup_ingredients