(S)-Benzyl (2-oxotetrahydrofuran-3-yl)carbamate

HCID 489185
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Basic information

CAS
35677-89-5
Standard SMILES
O=C(N[C@H]1CCOC1=O)OCc1ccccc1
InChIKey
FKWDZIFOVOUDAG-JTQLQIEISA-N
Molecular formula
C12H13NO4
Average molar mass
235.24 g/mol
Monoisotopic mass
235.0844579

Names & identifiers

Preferred name
(S)-Benzyl (2-oxotetrahydrofuran-3-yl)carbamate
IUPAC
benzyl N-[(3S)-2-oxooxolan-3-yl]carbamate
English name
N-Cbz-L-homoserine lactone
Molecular formula
C12H13NO4
Molecular weight
235.24

Names & synonyms

35677-89-5N-Cbz-L-homoserine lactoneCbz-L-Homoserine lactone(S)-Benzyl (2-oxotetrahydrofuran-3-yl)carbamateN-Z-L-Homoserine lactonebenzyl N-[(3S)-2-oxooxolan-3-yl]carbamateMFCD00674555N-Carbobenzoxy-L-homoserine LactoneN-Benzyloxycarbonyl-L-Homoserine lactone(S)-alpha-(Cbz-amino)-gamma-butyrolactone(S)-alpha-(Carbobenzoxyamino)-gamma-butyrolactonebenzyl N-[(3S)-2-oxotetrahydrofuran-3-yl]carbamate
Show more names
Z-L-HOMOSERINE LACTONE(S)-BenzyLZ-L-HOSER LACTONEZ-HoMoser lactoneZ-L-HomoSer lactoneZ-L-hoMoserineactoneN-Cbz-L-homoserine lCbz-L-HoMoserine laCLone
Cbz-Hse-Lactone(S)-benzyl 2-oxotetrahydrofuran-3-ylcarbamateCarbamic acid, [(3S)-tetrahydro-2-oxo-3-furanyl]-, phenylmethyl esterbenzyl (S)-(2-oxotetrahydrofuran-3-yl)carbamateN-((3S)-2-Oxo(3-3,4,5-trihydrofuryl))(phenylmethoxy)carboxamideSCHEMBL3169636CHEMBL4961783DTXSID001372452

Database identifiers

CAS
35677-89-5
PubChem CID
489185
DTXSID
DTXSID001372452
ChEMBL
CHEMBL4961783
Nikkaji
J729.062D

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
17

Physicochemical properties

Melting point
127 · 127-132 °C
Boiling point
466.1 · 466.1±44.0 °C(Predicted)
Density
1.27 · 1.27±0.1 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
powder to crystal
pka
11 · 11.00±0.20(Predicted)

Safety & regulation

Safety data

F
10
wgk
3
hs_code
2932.20.4500
Signal word
Warning
Symbol(GHS)
GHS07
safety_code
22-24/25

Chemistry & industry

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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