Basic information
- CAS
1912-31-8- Standard SMILES
CCCOS(C)(=O)=O- InChIKey
DKORSYDQYFVQNS-UHFFFAOYSA-N- Molecular formula
- C4H10O3S
- Average molar mass
- 138.19 g/mol
- Monoisotopic mass
- 138.03506535
Names & identifiers
- Preferred name
- Propyl methanesulfonate
- IUPAC
- propyl methanesulfonate
- English name
- propyl methanesulphonate
- Molecular formula
- C4H10O3S
- Molecular weight
- 138.19
Names & synonyms
Propyl methanesulfonate1912-31-8Propyl methanesulphonateMethanesulfonic acid, propyl estern-Propyl methane sulfonate9M6NKT0B5HNSC-49872DTXSID4031770RefChem:176502DTXCID2011770217-619-9n-Propyl methanesulfonate
Show more names
Propyl mesylate1-Propylmesylaten-Propylmesylate, 98 %PropylMethanesulfonate>n-propyl methane sulfonatePropionate methanesulflate
MFCD00007561NSC 49872Amlodipine Impurity VCCRIS 9161EINECS 217-619-9UNII-9M6NKT0B5HBRN 1750181AI3-50053
Database identifiers
- CAS
1912-31-8- PubChem CID
- 74705
- DTXSID
DTXSID4031770- UNII
- 9M6NKT0B5H
- EC Number
- 217-619-9
- Nikkaji
- J3.381B
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 130
Physicochemical properties
- Boiling point
- 110 °C/20mmHg · 110°C/20mmHg(lit.)
- Density
- 1.132 · 1.132 (estimate)
- refractive index
- 1.42 to · 1.4200 to 1.4250
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Sparingly), Methanol (Slightly)
- form
- clear liquid
- color
- Colorless to Light yellow to Light orange
- InChI
- InChI=1S/C4H10O3S/c1-3-4-7-8(2,5)6/h3-4H2,1-2H3
- InChIKey
- DKORSYDQYFVQNS-UHFFFAOYSA-N
- SMILES
- CS(OCCC)(=O)=O
- FDA UNII
- 9 M6NKT0B5H · 9M6NKT0B5H
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 501 · P501-P270-P264-P301+P312+P330
- RTECS
- 2680000 · PB2680000
- HS Code
- 2904100090 · 2904100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P318, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- rtecs
- PB2680000
- hs_code
- 2904100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P501-P270-P264-P301+P312+P330
Chemistry & industry
Suppliers82 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
陕西格列弗生物科技研究有限责任公司18409274651; 13892423764 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
湖北云镁科技有限公司027-59206672 18327059871 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
南京哈柏医药科技有限公司13376080562 13376090521 · [email protected]
石家庄建鑫生物科技有限公司0311-1906231-3169 19062313169 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
北京伊诺凯科技有限公司15652467323 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
广东顺奥化学试剂有限公司19928586137 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
苏州麦凯尔生物医药科技有限公司15952441622 · [email protected]
天津荣燊化工有限公司18317763565; 18317763565 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
常州安奈凯医药科技有限公司+86-0519-8359-8696 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
安阳鸿蒙新材料有限公司0372-19588588067 19588588067 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
西安莱茵生物科技有限公司86-(0)29-85992781 17792393971 · [email protected]
Related reactions
5 records
Compound notes
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