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N-((Phenylmethoxy)carbonyl)-S-(phenylmethyl)-L-cysteine

HCID 98775
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3257-18-9
Standard SMILES
O=C(N[C@@H](CSCc1ccccc1)C(=O)O)OCc1ccccc1
InChIKey
ATPNWHGYKFXQNF-INIZCTEOSA-N
Molecular formula
C18H19NO4S
Average molar mass
345.4 g/mol
Monoisotopic mass
345.10347926

Names & identifiers

Preferred name
N-((Phenylmethoxy)carbonyl)-S-(phenylmethyl)-L-cysteine
IUPAC
(2R)-3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid
English name
Z-Cys(Bzl)-OH
Molecular formula
C18H19NO4S
Molecular weight
345.41

Names & synonyms

3257-18-9S-Benzyl-N-benzyloxycarbonyl-L-cysteineDTXSID901204785N-((Phenylmethoxy)carbonyl)-S-(phenylmethyl)-L-cysteineN-[(Phenylmethoxy)carbonyl]-S-(phenylmethyl)-L-cysteineRefChem:1090735DTXCID101636205221-855-8Z-Cys(Bzl)-OHN-Cbz-S-benzyl-L-cysteineN-Carbobenzoxy-S-benzyl-L-cysteineMFCD00004785
Show more names
Z-CYS(BZL)CBZ-CYS(BZL)Z-L-CYS(BZL)-OHZ-S-Bzl-L-Cys-OHCbz-L-Cys(Bzl)-OHCbz-Cys(BCbzL)-OHZ-CYSTEINE(BZL)-OHZ-S-benzyl-L-cystein
Cbz-Cys(Bzl)-OHN-Benzyloxycarbonyl-S-benzyl-L-cysteineCbz-S-benzyl-L-cysteineCbz-(S)-benzyl-D-CysFD21235Benzyl-N-[(benzyloxy)carbonyl]-L-cysteineC2614s-Benzyl-N-carbobenzyloxy-L-cysteine

Database identifiers

CAS
3257-18-9
PubChem CID

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
101 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
24
Formal charge
0
Complexity
392

Physicochemical properties

Melting point
96 to · 96.0 to 100.0 °C
Boiling point
560.6 · 560.6±50.0 °C(Predicted)
Density
1.278 · 1.278±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
solubility
Acetone (Sparingly), Chloroform (Slightly), DMSO (Slightly)
form
Solid
pka
3.56 · 3.56±0.10(Predicted)
color
White to Off-White
CAS DataBase Reference
3257 · 3257-18-9(CAS DataBase Reference)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302
Precautionary statements
280 · P280-P305+P351+P338
WGK Germany
3 · 3
HS Code
2930.9 · 2930.90.2900

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 · 4 items

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Safety data

wgk
3
hs_code
2930.90.2900
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

Z-Cys(Bzl)-OMe

Suppliers65 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
上海相辉医药科技有限公司13761987713 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]

Related reactions

2 records
New reaction record
HRID 1733654 reaction equation
HRID 1733654As reactantuspto-grants-1980_12
HRID 1733655 reaction equation
HRID 1733655As reactantuspto-grants-1980_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
98775
DTXSID
DTXSID901204785
EC Number
221-855-8
Nikkaji
J80.676E
凯试(上海)科技有限公司
021-50135380 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
吉尔生化(玉门)有限公司18221406464 18221406464;13236395639 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
四川安派博生物科技有限公司028-65294243 18682730901 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
上海珈得尔化学技术有限公司13564435016 13564435016 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
四川嘉瑛莱科技有限责任公司9018 15982359653 · [email protected]
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
吉尔多肽生物制药(大连市)有限公司021-61263455 13167021076 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Capot Chemical Co.,Ltd.+86-(0)57185586718 +86-13336195806 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[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]
浙江联硕生物科技有限公司18616526224 · [email protected]
Aladdin Scientific[email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
无锡迈默拓普生物科技有限公司15061806929 · [email protected]
GL Biochem(Binhai) Ltd.+86-021-61263370 15301650015 · [email protected]