Basic information
- CAS
1217462-58-2- Standard SMILES
C[C@H](N=[N+]=[N-])C(=O)O.NC1CCCCC1- InChIKey
CGKQKHCXMKZFEF-WNQIDUERSA-N- Molecular formula
- C9H18N4O2
- Average molar mass
- 214.27 g/mol
- Monoisotopic mass
- 214.14297583
Names & identifiers
- Preferred name
- (2S)-2-Azidopropanoic acid--cyclohexanamine (1/1)
- IUPAC
- (2S)-2-azidopropanoic acid;cyclohexanamine
- English name
- (S)-2-Azido-propionic acid cyclohexylaMMoniuM salt
- Molecular formula
- C9H18N4O2
- Molecular weight
- 214.26482
Names & synonyms
1217462-58-2DTXSID50735012(2S)-2-Azidopropanoic acid--cyclohexanamine (1/1)RefChem:206957DTXCID60685756(2S)-2-azidopropanoic acid;cyclohexanamineMFCD11223822(2S)-2-azidopropanoic acid; cyclohexanamineC9H18N4O2N3-Ala.CHASCHEMBL17801910(S)-2-Azido-propanoic acid CHA
Show more names
(2S)-2-azidopropanoic acidcyclohexanaminium (S)-2-azidopropanoate(S)-2-Azido-propionic acid cyclohexylaMMoniuM salt(S)-2-Azido-propionic acid cyclohexylammonium salt(S)-2-Azido-propionic acid cyclohexylammonium salt >=98% (TLC)
AKOS015940931AS-80249G78989(S)-2-Azido-propionic acid cyclohexylammonium salt, >=98% (CE)
Database identifiers
- CAS
1217462-58-2- PubChem CID
- 66519952
- DTXSID
DTXSID50735012- EC Number
- 693-729-4
Properties
Computed structural properties
- Topological polar surface area
- 77.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- form
- solid
- color
- White
- optical activity
- 12 · [α]/D +12.0±1.0°, c =1 in methanol
- Major Application
- peptide synthesis
- InChI
- 1S/C6H13N.C3H5N3O2/c7-6-4-2-1-3-5-6;1-2(3(7)8)5-6-4/h6H,1-5,7H2;2H,1H3,(H,7,8)/t;2-/m.0/s1
- InChIKey
- CGKQKHCXMKZFEF-WNQIDUERSA-N
- SMILES
- NC1CCCCC1.C[C@H](N=[N+]=[N-])C(O)=O
- UNSPSC Code
- 12352202 · 12352202
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- WGK 3
- hs_code
- 2929900090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
Usespeptide synthesis
Suppliers27 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
ChemPep, Inc.+1 (888) 615-9178 / (561) 791-8787 · [email protected]
南通裕健医药科技有限公司13962794339 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
GL Biochem (Shanghai) Ltd.+86-021-61263370 +86-18901917034
上海研纷生化科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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