Completing data — refresh the page later to see the latest
Basic information
- CAS
5107-93-7- Standard SMILES
COC(=O)C1CC(OCc2ccccc2)C1- InChIKey
COSCRJLYEZUUMW-UHFFFAOYSA-N- Molecular formula
- C13H16O3
- Average molar mass
- 220.26 g/mol
- Monoisotopic mass
- 220.10994437
Names & identifiers
- Preferred name
- Methyl 3-(benzyloxy)cyclobutanecarboxylate
- IUPAC
- methyl 3-phenylmethoxycyclobutane-1-carboxylate
- English name
- Cyclobutanecarboxylic acid, 3-(phenylMethoxy)-, Methyl ester, trans-
- Molecular formula
- C13H16O3
- Molecular weight
- 220.26
Names & synonyms
4934-98-9METHYL 3-(BENZYLOXY)CYCLOBUTANECARBOXYLATE84182-49-084182-50-3Methyl cis-3-(benzyloxy)cyclobutanecarboxylateMethyl trans-3-(benzyloxy)cyclobutanecarboxylateMETHYL 3-(BENZYLOXY)CYCLOBUTANE-1-CARBOXYLATEmethyl 3-phenylmethoxycyclobutane-1-carboxylateMFCD00513559Methyl cis-3-benZyloxycyclobutanecarboxylateMethyl trans-3-benZyloxycyclobutanecarboxylatemethyl 3-benzyloxycyclobutanecarboxylate
Show more names
trans-3-Benzyloxycyclobutanecarboxylic acid methyl esterMethyl trans-3-(benzyloxy)cyclobutanecarboxylate - [M13163]
Methyl 3-(phenylmethoxy)cyclobutanecarboxylateCyclobutanecarboxylic acid, 3-(phenylmethoxy)-, methyl ester, cis-5107-93-7Cyclobutanecarboxylic acid, 3-(phenylmethoxy)-, methyl ester, trans-MFCD22123751MFCD22123752METHYL (1R,3R)-3-(BENZYLOXY)CYCLOBUTANE-1-CARBOXYLATECyclobutanecarboxylic acid, 3-(phenylmethoxy)-, methyl ester
Database identifiers
- CAS
5107-93-7、84182-50-3
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Boiling point
- 298.009 · 298.009±33.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.117 · 1.117±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 0 · Store at 0-8 °C
- Appearance
- yellow liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers5 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
宁波苯康基石医药科技有限公司15990591583
江阴康源生物医药科技有限公司0510-86010668 13395169561 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
2 records
Compound notes
Loading…