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(S)-2-(((Benzyloxy)carbonyl)amino)hexanedioic acid

HCID 7019809
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
24325-14-2
Standard SMILES
O=C(O)CCC[C@H](NC(=O)OCc1ccccc1)C(=O)O
InChIKey
SFOMJKAHGVQMPU-NSHDSACASA-N
Molecular formula
C14H17NO6
Average molar mass
295.29 g/mol
Monoisotopic mass
295.10558726

Names & identifiers

Preferred name
(S)-2-(((Benzyloxy)carbonyl)amino)hexanedioic acid
IUPAC
(2S)-2-(phenylmethoxycarbonylamino)hexanedioic acid
English name
Z-Aad-OH
Molecular formula
C14H17NO6
Molecular weight
295.29

Names & synonyms

24325-14-2(S)-2-(((Benzyloxy)carbonyl)amino)hexanedioic acidZ-AAD-OHCbz-Aad-OHMFCD00237377Cbz-(S)-2-aminoadipic acid(2S)-2-(phenylmethoxycarbonylamino)hexanedioic acid(S)-2-(((Benzyloxy)carbonyl)amino)hexanedioicacidSCHEMBL5711264DTXSID40427176SFOMJKAHGVQMPU-NSHDSACASA-N(2S)-2-{[(BENZYLOXY)CARBONYL]AMINO}HEXANEDIOIC ACID
Show more names
Z-L-Aad-OHZ-AAD(2)-OHZ-HOMOGLU-OHZ-AAD(ALPHA)-OHZ-L-aminoadipic acidZ-L-homoglutamic acidCBZ-L-AMINOADIPIC ACID(S)-2-(Z-amino)-hexane
Hexanedioicacid, 2-[[(phenylmethoxy)carbonyl]amino]-, (2S)-(S)-2-(Cbz-amino)hexanedioic AcidAKOS016003129(2S)-2-benzyloxycarbonylaminoadipic acidSY507474CS-0323898C78089(2S)-2-(benzyloxycarbonylamino)hexanedioic acid

Database identifiers

CAS
24325-14-2
PubChem CID
7019809

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
113 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
21
Formal charge
0
Complexity
364

Physicochemical properties

Melting point
163 ℃ · 163℃
Boiling point
551.9 · 551.9±50.0 °C(Predicted)
Density
1.322 · 1.322±0.06 g/cm3(Predicted)
storage temp.
2 · Sealed in dry,2-8°C
pka
3.91 · 3.91±0.21(Predicted)

Chemistry & industry

Upstream & downstream products

Downstream products

L-2-Aminoadipic acid(S)-2-Piperidinone-6-carboxylic acid

Suppliers12 total

北京华美互利生物化工010-56205725 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
石家庄瑞田生化有限公司15831127780 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]

Related reactions

1 records
New reaction record
HRID 481437 reaction equation
HRID 481437As productuspto-grants-1998_08

Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
DTXSID
DTXSID40427176
Nikkaji
J2.210.922G
Nextpeptide Inc
+86-0571-81612335 +8613336028439 · [email protected]