N6-벤조일-5'-O-(4,4'-디메톡시트리틸)-2'-탈산아데노신

Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-

HCID 2724489
노트반응
부분 구조 검색유사 구조 찾기

기본 정보

CAS
64325-78-6
표준 SMILES
COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)C[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1
InChIKey
LPICNYATEWGYHI-WIHCDAFUSA-N
분자식
C38H35N5O6
평균 분자량
657.7 g/mol
단동위원소 질량
657.25873384

이름 및 식별자

우선 이름
Adenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-
IUPAC
N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]purin-6-yl]benzamide
현지명
N6-벤조일-5'-O-(4,4'-디메톡시트리틸)-2'-탈산아데노신
영어명
N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine
분자식
C38H35N5O6
분자량
657.71

이름 및 동의어

DMBTAAdenosine, N-benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxy-EINECS 264-776-4N-benzoyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxyadenosineDTXSID6074964Adenosine, N-benzoyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-N-Benzoyl-5'-O-(bis(4-methoxyphenyl)phenylmethyl)-2'-deoxyadenosineRefChem:317288DTXCID6044270264-776-464325-78-6N6-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine
이름 더 보기
N6-벤조일-5'-O-(4,4'-디메톡시트리틸)-2'-탈산아데노신N6-벤조일-5'-O-(4,4'-디메톡시트리틸)-2'-탈산아데노신(N6-BENZOYL-5'-O-(4,4'-D...5'-O-DMT-N6-Bz-dADMT-Bz-dADMT-DA-BZDMT-N-BZ-DAN6-Bz-DMT-dA5'-DMT-Bz-dAN6-Bz-DMT-2'-dA5'-ODMT N-Bz dA-O-nosylthymidine
Bz-DMT-dAMFCD00010058N6-Benzoyl-5 inverted exclamation marka-O-(4,4 inverted exclamation marka-dimethoxytrityl)-2 inverted exclamation marka-deoxyadenosine5'-O-DMT-N6-Benzoyl-2'-DeoxyadenosineAdenosine, N-benzoyl-5'-O-SCHEMBL3824084N-[9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]purin-6-yl]benzamideN(6)-Benzoyl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyadenosine

데이터베이스 식별자

CAS
64325-78-6
PubChem CID
2724489
DTXSID
DTXSID6074964
EC Number
264-776-4
Nikkaji
J310.093F

물성

구조 계산 물성

XLogP
4.8
극성 표면적
130 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
9
회전 가능 결합 수
11
무거운 원자 수
49

실험 및 물리화학적 성질

CosmeticsCosmetics ingredient -> Conditioning/Emollient; Moisturizing/Humectant

물리화학적 성질

녹는점
94 °C · 94 °C
끓는 점
681.42 °C · 681.42°C (rough estimate)
밀도
1.2199 · 1.2199 (rough estimate)
굴절률
-10 ° · -10 ° (C=1, MeOH)
저장 조건
Inert atmosphere,Room Temperature
용해도
DMSO(약간 용해됨), 메탄올(약간 용해됨, 가열)

화학적 성질

white granular solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Hazard Traits - Bioaccumulation; Environmental Persistence

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

REACH registered substance: N-benzoyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxyadenosine (EC: 264-776-4)

Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29349990
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
22-24/25-36-26

화학 및 산업

용도 및 제조

Household ProductsCosmetics product ingredient: Adenosine, N-benzoyl-5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-
General Manufacturing InformationAdenosine, N-benzoyl-5'-O-[bis(4-methoxyphenyl)phenylmethyl]-2'-deoxy-: ACTIVE

상·하류 제품 정보

공급사100 곳

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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]

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