Basic information
- CAS
1315053-41-8- Standard SMILES
Cl.NC(=O)[C@H]1CC(F)(F)CN1- InChIKey
RRQDQYAEZGKHOB-AENDTGMFSA-N- Molecular formula
- C5H9ClF2N2O
- Average molar mass
- 186.59 g/mol
- Monoisotopic mass
- 186.03714703
Names & identifiers
- Preferred name
- (R)-4,4-Difluoropyrrolidine-2-carboxamide hydrochloride
- IUPAC
- (2R)-4,4-difluoropyrrolidine-2-carboxamide;hydrochloride
- English name
- 4,4-Difluoro-D-prolinamide hydrochloride
- Molecular formula
- C5H9ClF2N2O
- Molecular weight
- 186.59
Names & synonyms
1315053-41-8(R)-4,4-Difluoropyrrolidine-2-carboxamide hydrochloride4,4-DIFLUORO-D-PROLINAMIDE HYDROCHLORIDEMFCD06797015(2R)-4,4-difluoropyrrolidine-2-carboxamide;hydrochloride(2R)-4,4-difluoropyrrolidine-2-carboxamide hydrochlorideSCHEMBL157763722-Pyrrolidinecarboxamide, 4,4-difluoro-, hydrochloride (1:1), (2R)-C5H9ClF2N2OD793364,4-Difluoro-D-prolinamide--hydrogen chloride (1/1)(R)-4,4-Difluoropyrrolidine-2-carboxamidehydrochloride
Show more names
hydrochloride - [D82314](2R)-4,4-difluoropyrrolidine-2-carboxamide(R)-4,4-difluoropyrrolidine-2-carboxamide HCl(2R)-4,4-difluoro-D-proline amide hydrochloride(R)-4,4-difluoropyrolidine-2-carboxamidehydrochloride
A8884174,4-Difluoro-D-Prolinamide HClDTXSID20669799WLZ4270AKOS006284279AS-79301SY038576DB-353596
Database identifiers
Properties
Computed structural properties
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- form
- solid
- InChI
- 1S/C5H8F2N2O.ClH/c6-5(7)1-3(4(8)10)9-2-5;/h3,9H,1-2H2,(H2,8,10);1H/t3-;/m1./s1
- InChIKey
- RRQDQYAEZGKHOB-AENDTGMFSA-N
- SMILES
- NC([C@@H]1NCC(F)(F)C1)=O.Cl
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315-H302+H312+H332
- Precautionary statements
- 280 · P280-P301+P312-P362+P364
- WGK Germany
- 3 · WGK 3
- HS Code
- 2933998090 · 2933998090
- Storage Class
- 11 · 11 - Combustible Solids
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
- wgk
- WGK 3
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H319-H335-H315-H302+H312+H332
- Precautionary statements
- P280-P301+P312-P362+P364
Chemistry & industry
Suppliers19 total
南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
上海铱鑫医药科技有限公司13671725141 · [email protected]
南京唯博特医药科技有限公司18066048793; 18014498793 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
武汉壹加壹生物科技有限公司027-027-16602739303 16602739303 · [email protected]
南通华祥医药科技有限公司+86-15716293042 15716293042 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
BTC Nantong Pharmaceuticals Technology Co.,Ltd+86-0513-81283365 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Shanghai Joy Biotech Ltd.+86-15968534750 +86-1358845959750 · [email protected]
Alchem Pharmtech,Inc.
Related reactions
4 records
Compound notes
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