Basic information
- CAS
117903-25-0- Standard SMILES
CCCC[C@@H](C(=O)O)N(C)C(=O)OC(C)(C)C- InChIKey
HYGQYTQHPSQSFF-VIFPVBQESA-N- Molecular formula
- C12H23NO4
- Average molar mass
- 245.32 g/mol
- Monoisotopic mass
- 245.16270821
Names & identifiers
- Preferred name
- Boc-N-Me-Nle-OH
- IUPAC
- (2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic acid
- English name
- BOC-MENLE-OH
- Molecular formula
- C12H23NO4
- Molecular weight
- 245.32
Names & synonyms
117903-25-0Boc-N-Me-Nle-OHBoc-Menle-OhBoc-N-methyl-L-norleucinen-tert-butoxycarbonyl-n-methyl-l-norleucineMFCD00153391(S)-2-((tert-Butoxycarbonyl)(methyl)amino)hexanoic acidN-Boc-N-methyl-L-norleucine(2S)-2-{[(tert-butoxy)carbonyl](methyl)amino}hexanoic acid(2S)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic AcidL-Norleucine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-Boc-N-Me-L-2-aminohexanoic acid
Show more names
BOC-L-MENLE-OHBoc-L-MeNIe-OHBOC-MEAHX(2)-OHBOC-MEACPO(2)-OHBoc-N-Me-L-Nle-OHBOC-N-ME-NORLEUCINEBoc-N-Me-Nle-OH(oil)
N-(tert-butoxycarbonyl)-N-methyl-L-norleucineSCHEMBL66398Boc-Nalpha-methyl-L-norleucineDTXSID40426826HYGQYTQHPSQSFF-VIFPVBQESA-NAKOS015836724AS-65711SY032863
Database identifiers
- CAS
117903-25-0- PubChem CID
- 7016367
- DTXSID
DTXSID40426826- Nikkaji
- J943.980C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 270
Physicochemical properties
- Boiling point
- 343.6 · 343.6±21.0 °C(Predicted)
- Density
- 1.055 · 1.055±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 4.03 · 4.03±0.21(Predicted)
- Appearance
- yellow oil
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H319
- Precautionary statements
- 280 · P280-P305+P351+P338
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- HS Code
- 2924190090 · 2924190090
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
- 3
- hs_code
- 2924190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H317-H319
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers49 total
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海嘉莱多生物技术有限责任公司021-61732478 19946252459 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
凯试(上海)科技有限公司021-50135380 · [email protected]
ChemPep, Inc.+1 (888) 615-9178 / (561) 791-8787 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
深圳市茵诺圣生物科技有限公司0755-28351685 18503098468 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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