Catalog Number |
ACM110928444-1 |
CAS |
110928-44-4 |
Structure |
|
IUPAC Name |
methyl 4-(hydroxymethyl)cyclohexane-1-carboxylate |
Synonyms |
110928-44-4;methyl 4-(hydroxymethyl)cyclohexanecarboxylate;13380-85-3;(1r,4r)-methyl 4-(hydroxymethyl)cyclohexanecarboxylate;trans-Methyl 4-(hydroxymethyl)cyclohexanecarboxylate;Methyl trans-4-(hydroxymethyl)cyclohexanecarboxylate;METHYL TRANS-4-HYDROXYMETHYLCYCLOHEXANECARBOXYLATE;Cyclohexanecarboxylic acid, 4-(hydroxymethyl)-, methyl ester, trans-;methyl (1r,4r)-4-(hydroxymethyl)cyclohexane-1-carboxylate;Methyl 4-(hydroxymethyl)cyclohexane-1-carboxylate;110928-45-5;4-hydroxymethyl-cyclohexanecarboxylic acid methyl ester;METHYL CIS-4-HYDROXYMETHYLCYCLOHEXANE-1-CARBOXYLATE;Cyclohexanecarboxylic acid, 4-(hydroxymethyl)-, methyl ester, cis-;UNII-M86577ODUE;UNII-R58V1A8V4H;M86577ODUE;R58V1A8V4H;MFCD03840884;cis-methyl 4-hydroxymethylcyclohexanecarboxylate;cis-methyl 4-(hydroxymethyl)cyclohexanecarboxylate;trans-methyl 4-hydroxymethylcyclohexanecarboxylate;trans-4-hydroxymethyl-cyclohexanecarboxylic acid methyl ester;ACMC-20mdt9;ACMC-20c3w9;Methyl 4-hydroxymethylcyclohexanecarboxylate, cis-;SCHEMBL351398;SCHEMBL351399;SCHEMBL408809;SCHEMBL12204505;SCHEMBL14450649;AMCH00028;DTXSID00928275;BCP27209;CS-D1138;ZINC2579683;MFCD06799220;4-Carbomethoxy-cyclohexane-1-methanol;AKOS005145544;AKOS006284052;AKOS015851380;ZINC100009993;ZINC100590388;DS-5562;SB11024;SB32898;AK-50934;AK127521;cis-4-(Methoxycarboxyl)cyclohexanemethanol;DS-15567;SY098890;Methyl 4-hydroxymethylcyclohexanecarboxylate;trans-4-(Methoxycarbonyl)cyclohexanemethanol;AM20070447;FT-0688795;X8966;S-5039;Methyl 4-hydroxymethylcyclohexanecarboxylate, trans-;methyl trans-4-(hydroxymethyl)cyclohexane-carboxylate;Q27283613;Q27287806;trans-methyl 4-(hydroxymethyl)cyclohexane carboxylate;4-hydroxymethyl-cyclohexane carboxylic acid methyl ester;METHYLTRANS-4-HYDROXYMETHYLCYCLOHEXANECARBOXYLATE;trans-4-(Hydroxymethyl)cyclohexanecarboxylic acid methyl ester;trans-4-(Hydroxymethyl)cyclohexanecarboxylic acid, methyl ester;UNII-93403M505F component KOGYKIDJFOMAOF-OCAPTIKFSA-N;UNII-93403M505F component KOGYKIDJFOMAOF-ZKCHVHJHSA-N;(1R,4R)-4-(hydroxymethyl)cyclohexanecarboxylic acid methyl ester |
Molecular Weight |
172.22g/mol |
Molecular Formula |
C9H16O3 |
Canonical SMILES |
COC(=O)C1CCC(CC1)CO |
InChI |
InChI=1S/C9H16O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h7-8,10H,2-6H2,1H3 |
InChI Key |
KOGYKIDJFOMAOF-UHFFFAOYSA-N |
Complexity |
148 |
Covalently-Bonded Unit Count |
1 |
Exact Mass |
172.109944368g/mol |
Heavy Atom Count |
12 |
Hydrogen Bond Acceptor Count |
3 |
Monoisotopic Mass |
172.109944368g/mol |
Rotatable Bond Count |
3 |
Topological Polar Surface Area |
46.5Ų |
UNII |
M86577ODUE;R58V1A8V4H |
X Log P3 |
0.9 |