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tert-Butyl [(3S)-1-chloro-4-methyl-2-oxopentan-3-yl]carbamate

HCID 13919082
NotesReactions

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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
103542-47-8
Standard SMILES
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)CCl
InChIKey
HQCFUDZWXVYJEF-VIFPVBQESA-N
Molecular formula
C11H20ClNO3
Average molar mass
249.738 g/mol
Monoisotopic mass
249.11317118

Names & identifiers

Preferred name
tert-Butyl [(3S)-1-chloro-4-methyl-2-oxopentan-3-yl]carbamate
IUPAC
tert-Butyl [(3S)-1-chloro-4-methyl-2-oxopentan-3-yl]carbamate
English name
Boc-Val-CMK
Molecular formula
C11H20ClNO3
Molecular weight
249.73

Names & synonyms

Boc-L-Val-CMKBoc-Val-CMKBoc-L-Valine chloromethyl ketone≥ 98% (HPLC)Carbamic acid, [3-chloro-1-(1-methylethyl)-2-oxopropyl]-, 1,1-dimethylethyl ester, (S)- (9CI)

Database identifiers

CAS
103542-47-8
PubChem CID
13919082
DTXSID
DTXSID50552488
EC Number
114-118-6
Nikkaji
J835.959H

Properties

Physicochemical properties

Melting point
68 · 68-69 °C
Boiling point
334.3 · 334.3±22.0 °C(Predicted)
Density
1.077 · 1.077±0.06 g/cm3(Predicted)
pka
10.9 · 10.90±0.46(Predicted)

Chemistry & industry

Applications

UsesBOC-valine-chloromethyl ketone is an amino acid derivative used in peptide synthesis and pharmaceutical research.

Suppliers12 total

常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
重庆张邦医药科技有限责任公司028-84252981 18583719936 · [email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
河南伊诺凯新材料有限公司13290191024 13290191024 · [email protected]
四川众诚医药化工有限公司028-83126208 19981688298 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Capot Chemical Co., Ltd+86 (0) 571 85 58 67 18
湖南汇百益新材料有限公司0745-2866551 19976851779 · [email protected]
河南梦泰医药科技有限公司17634413542 · [email protected]

Related reactions

5 records
New reaction record
HRID 236459 reaction equation
HRID 236459As productuspto-grants-1987_02
HRID 236460 reaction equation
HRID 236460As reactantuspto-grants-1987_02
HRID 980405 reaction equation
HRID 980405As productuspto-grants-1987_01
HRID 980406 reaction equation
HRID 980406As reactantuspto-grants-1987_01
HRID 1380613 reaction equation
HRID 1380613As productuspto-grants-1986_04

Compound notes

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