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(2S,4R)-1-(tert-Butoxycarbonyl)-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid

HCID 2762011
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Basic information

CAS
959582-82-2
Standard SMILES
CC(C)(C)OC(=O)N1C[C@H](Cc2cccc3ccccc23)C[C@H]1C(=O)O
InChIKey
ULPULYXIMLDLIM-KDOFPFPSSA-N
Molecular formula
C21H25NO4
Average molar mass
355.4 g/mol
Monoisotopic mass
355.17835828

Names & identifiers

Preferred name
(2S,4R)-1-(tert-Butoxycarbonyl)-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid
IUPAC
(2S,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid
English name
(2S,4R)-1-(tert-butoxycarbonyl)-4-(naphthalen-1-ylMethyl)pyrrolidine-2-carboxylic acid
Molecular formula
C21H25NO4
Molecular weight
355.43

Names & synonyms

959582-82-2(2S,4R)-1-(tert-Butoxycarbonyl)-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acidMFCD06659417Boc-(R)-gamma-(1-naphthalenylmethyl)-L-proline(2S,4R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acidN-Boc-(4R)-4-(1-naphthalenylmethyl)-L-prolineDTXSID00376030(2S,4R)-1-[(tert-butoxy)carbonyl]-4-[(naphthalen-1-yl)methyl]pyrrolidine-2-carboxylic acidAKOS015949855(2S,4R)-1-tert-butoxycarbonyl-4-(1-naphthylmethyl)pyrrolidine-2-carboxylic acidPS-12661F10073
Show more names
Boc-(R)-3-(1-naphthalenylmethyl)-L-proline(Tert-Butoxy)Carbonyl (R)-γ-(1-naphthalenylmethyl)-L-ProN-(t-Butoxycarbonyl)-trans-4-(1-naphthylmethyl)-L-prolineBoc-(2S,4R)-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylicacid1,2-Pyrrolidinedicarboxylic acid, 4-(1-naphthalenylmethyl)-, 1-(1,1-dimethylethyl) ester, (2S,4R)-
(4R)-1-(tert-Butoxycarbonyl)-4-[(naphthalen-1-yl)methyl]-L-proline(2S,4R)-1-(tert-Butoxycarbonyl)-4-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylicacid

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
66.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
527

Physicochemical properties

Boiling point
528.7 · 528.7±43.0 °C(Predicted)
Density
1.218 · 1.218±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
3.94 · 3.94±0.40(Predicted)

Chemistry & industry

Suppliers15 total

上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
上海英奇曼化学科技有限公司18299177127 · [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
吉尔多肽生物制药(大连市)有限公司021-61263455 13167021076 · [email protected]
上海智乾生物科技有限公司[email protected]
康化(上海)新药研发有限公司021-61263370 18516560301 · [email protected]
上海吉奉生物科技有限公司021-61263377 15023907684 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
上海梦蓝医药科技有限公司13062660007 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
959582-82-2
PubChem CID
2762011
DTXSID
DTXSID00376030
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]