Basic information
- CAS
16012-70-7- Standard SMILES
C[C@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)O- InChIKey
JBGCVTHXXTVYIP-UWVGGRQHSA-N- Molecular formula
- C14H18N2O5
- Average molar mass
- 294.3 g/mol
Names & identifiers
- Preferred name
- N-((Phenylmethoxy)carbonyl)-L-alanyl-L-alanine
- IUPAC
- (2S)-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid
- English name
- Z-Ala-Ala-OH
- Molecular formula
- C14H18N2O5
- Molecular weight
- 294.3
Names & synonyms
16012-70-7RefChem:1090729N-((Phenylmethoxy)carbonyl)-L-alanyl-L-alanineZ-ALA-ALA-OH(S)-2-((S)-2-(((Benzyloxy)carbonyl)amino)propanamido)propanoic acidMFCD00037234L-Alanyl(benzyloxycarbonyl)-L-alanineN-Cbz-L-alanyl-L-alanineL-Alanine, N-[(phenylmethoxy)carbonyl]-L-alanyl-(2S)-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid((Benzyloxy)carbonyl)-L-alanyl-L-alanineCbz-L-alanyl-L-alanine
Show more names
Cbz-Ala-AlaN-cbz-ala-alaEinecs 240-149-0Z-L-Ala-L-Ala-OHCbz-L-Ala-Ala-OHCbz-L-Ala-L-Ala-OHZ-L-ALANYL-L-ALANINE
(2S)-2-[(2S)-2-{[(BENZYLOXY)CARBONYL]AMINO}PROPANAMIDO]PROPANOIC ACIDbenzyloxycarbonylalanyl alanineCbz-Ala-Ala-OHSCHEMBL3358693CHEMBL2372591N-carbobenzoxy-L-alanyl-L-alanineAKOS022181417N-benzyloxycarbonyl-L-alanyl-L-alanine
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 380
Physicochemical properties
- Melting point
- 136 · 136-140 °C
- Boiling point
- 573 · 573.0±45.0 °C(Predicted)
- Density
- 1.252 · 1.252±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- pka
- 3.51 · 3.51±0.10(Predicted)
- form
- Solid
- color
- White to off-white
- optical activity
- -23.3 ° · -23.3° (C=1.00 g/100ml ETHANOL)
- InChI
- 1S/C14H18N2O5/c1-9(12(17)15-10(2)13(18)19)16-14(20)21-8-11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3,(H,15,17)(H,16,20)(H,18,19)/t9-,10-/m0/s1
- InChIKey
- JBGCVTHXXTVYIP-UWVGGRQHSA-N
- SMILES
- O=C(N[C@@H](C)C(N[C@@H](C)C(O)=O)=O)OCC1=CC=CC=C1
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
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
- wgk
- WGK 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesZ-Ala-Ala-OH is a non-polar amino acid that can be used in enzymatic peptide synthesis[1].
Upstream & downstream products
Downstream products
Suppliers82 total
江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海康恩博科技有限公司（科小研试剂）400-1388-521 17673770086 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Sichuan Jiaying Lai Technology Co.,LTD18716376478 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Related reactions
6 records
Compound notes
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