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N-(4-Nitrophenylsulfonyl)-L-phenylalanine

HCID 7019161
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
64501-87-7
Standard SMILES
O=C(O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1
InChIKey
JVHRPLXWZFPXIJ-AWEZNQCLSA-N
Molecular formula
C15H14N2O6S
Average molar mass
350.3 g/mol
Monoisotopic mass
350.05725717

Names & identifiers

Preferred name
N-(4-Nitrophenylsulfonyl)-L-phenylalanine
IUPAC
(2S)-2-[(4-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid
English name
N-(4-Nitrophenylsulfonyl)-L-phenylalanine
Molecular formula
C15H14N2O6S
Molecular weight
350.35

Names & synonyms

N-(4-Nitrophenylsulfonyl)-L-phenylalanine64501-87-7MFCD00191470(S)-2-(4-Nitrophenylsulfonamido)-3-phenylpropanoic acid(2S)-2-[(4-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid(2S)-2-(4-NITROBENZENESULFONAMIDO)-3-PHENYLPROPANOIC ACIDnosyl-l-phenylalanineSCHEMBL5189459DTXSID50427081STK367323AKOS005444275HY-W141793
Show more names
N-Nosyl-L-Phenylalanine-OHNitrophenylsulfonylphenylalanineN-(4-Nitrophenylsulfonyl)-L-phenylalanine>L-Phenylalanine,N-[(4-nitrophenyl)sulfonyl]-N-(4-NITROPHENYLSULFONYL)-L-PHENYLALANINE USP/EP/BP2-(4-nitrophenylsulphonamido)-3-phenylpropanoic acid(2S)-2-[(4-nitrophenyl)sulfonylamino]-3-phenylpropanoicaci
AS-69889DA-75859N-(p-Nitrophenylsulfonyl)-l-phenylalanineSY106015N-[(4-Nitrophenyl)sulfonyl]phenylalanine #CS-0201590N-[(4-nitrophenyl)sulfonyl]-L-phenylalanineN0580

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
138 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
539

Physicochemical properties

Melting point
169 °C · 169 °C
Boiling point
582.7 · 582.7±60.0 °C(Predicted)
Density
1.456 · 1.456±0.06 g/cm3(Predicted)
refractive index
-19 ° · -19 ° (C=3, Acetone)
storage temp.
Sealed in dry,Room Temperature
form
powder to crystal
pka
3.15 · 3.15±0.10(Predicted)
color
White to Light yellow
HS Code
2935.9 · 2935.90.9500

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

hs_code
2935.90.9500

Chemistry & industry

Suppliers27 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [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]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
64501-87-7
PubChem CID
7019161
DTXSID
DTXSID50427081
Nikkaji
J534.134E
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
苏州昊帆生物股份有限公司0512-68417696 13732629933 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]