Basic information
- CAS
23669-79-6- Standard SMILES
COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)C[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1- InChIKey
BYGKUWPLEGHFKX-ZRRKCSAHSA-N- Molecular formula
- C30H30N2O7
- Average molar mass
- 530.6 g/mol
- Monoisotopic mass
- 530.2053013
Names & identifiers
- Preferred name
- 5'-O-(bis(4-methoxyphenyl)benzyl)-2'-deoxyuridine
- IUPAC
- 1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
- English name
- 5'-O-(4,4'-Dimethoxytrityl)-2'-deoxyuridine
- Molecular formula
- C30H30N2O7
- Molecular weight
- 530.58
Names & synonyms
EINECS 245-814-95'-O-(Bis(4-methoxyphenyl)benzyl)-2'-deoxyuridine5'-O-[Bis(4-methoxyphenyl)benzyl]-2'-deoxyuridineRefChem:527509245-814-923669-79-65'-O-(4,4'-Dimethoxytrityl)-2'-deoxyuridineMFCD000634102'-Deoxy-5'-O-DMT-uridineUridine, 5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-C30H30N2O75'-O-DMT-2'-deoxyuridine
Show more names
DMT-2'-dU5’-O-DMTr-dUDMT-DEOXYURIDINE5'-DMT-2'-deoxyuridine5’-O-DMTr-2’-deoxyuridine
1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dioneDMT-dU2'-deoxy-5'-O-(4,4'-dimethoxytrityl)uridine1-((2R,4S,5R)-5-((bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-4-hydroxytetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione1-[(2R,4S,5R)-5-{[bis(4-methoxyphenyl)(phenyl)methoxy]methyl}-4-hydroxyoxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione5'-DMT-dU5'-O-DMT-dUSCHEMBL912656
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 835
Physicochemical properties
- Melting point
- 120 °C · 120 °C
- Density
- 1.294 · 1.294±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- solubility
- 20 mg/ml · Soluble in acetonitrile at 20mg/ml
- form
- Powder
- pka
- 9.39 · 9.39±0.10(Predicted)
- color
- White to Off-white
- optical activity
- 7.03 ° · 7.03°(C=0.01g/mI, DMF, 20°C, 589nm)
- Symbol(GHS)
- 7 · GHS07,GHS06
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335-H301
- Precautionary statements
- 280 a-P301+P310a-P405-P501a-P261-P305+P351+P338 · P280a-P301+P310a-P405-P501a-P261-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/22-36/37/38
- Safety Statements
- 22 · 22-26-36
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 29349990
- risk_code
- 20/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS06
- hazard_code
- Xn
- safety_code
- 22-26-36
- Hazard statements
- H302-H315-H319-H332-H335-H301
- Precautionary statements
- P280a-P301+P310a-P405-P501a-P261-P305+P351+P338
Chemistry & industry
Applications
UsesIt is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.
Upstream & downstream products
Upstream raw materials
Suppliers74 total
北京华美互利生物化工010-56205725 · [email protected]
青岛鼎新海诺商贸有限公司18661607483 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
INNOBIO PHARM CO.,LTD+86-15600141006 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海哲研生物科技有限公司021-18017610038 18017610038 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海药诚医药科技合伙企业（有限合伙）400-6181121 18616381138 · [email protected]
Hangzhou Verychem Science And Technology Co.Ltd+86-86-57188162785 +8613606544505 · [email protected]
Related reactions
1 records
Compound notes
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